Flibanserin

Flibanserin

SCHEMBL563586

Cl.O=c1[nH]c2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Flibanserin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A known ✓ P08908 5/20 0.98
ADRA2A known ✓ P08913 1/20 0.98
CHRM1 known ✓ P11229 1/20 0.98
DRD1 known ✓ P21728 1/20 0.98
SLC6A4 known ✓ P31645 1/20 0.98
ADRA1A known ✓ P35348 1/20 0.98
OPRM1 known ✓ P35372 1/20 0.98
DRD3 known ✓ P35462 1/20 0.98
KCNH2 known ✓ Q12809 1/20 0.98
HTR7 known ✓ P34969 8/20 0.70
SIGMAR1 known ✓ Q99720 2/20 0.57
DRD2 known ✓ P14416 3/20 0.56
HTR2A known ✓ P28223 2/20 0.56
GAA known ✓ P10253 1/20 0.54
ABCB11 O95342 1/20 0.98
ADORA3 P0DMS8 1/20 0.98
TBXA2R P21731 1/20 0.98
NPSR1 Q6W5P4 2/20 0.57
LMNA P02545 2/20 0.54
TP53 P04637 2/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Flibanserin SCHEMBL29399513 0.99 HTR1A (1.00) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL247579 0.99 HTR1A (1.00) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL30249132 0.99 HTR1A (1.00) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL2526226 0.98 HTR1A (0.98) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL19743166 0.98 HTR1A (0.98) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL19743151 0.98 HTR1A (0.98) HTR1AABCB11ADRA2AADORA3CHRM1
SCHEMBL8123196 0.95 HTR1A (0.92) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL2525812 0.94 HTR1A (0.90) HTR1AABCB11ADRA2AADORA3CHRM1
Flibanserin SCHEMBL2521706 0.94 HTR1A (0.90) HTR1AABCB11ADRA2AADORA3CHRM1
SCHEMBL8121051 0.93 HTR1A (0.88) HTR1AABCB11ADRA2AADORA3CHRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 121 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107235913-B Method for efficiently manufacturing high-quality flibanserin on industrial scale 苏州科伦药物研究有限公司 2020-07-10 CN claimed
CN-111303043-A Preparation method of flibanserin hydrochloride 武汉万知化工医药有限公司 2020-06-19 CN claimed
CN-109232434-A A kind of new method synthesizing flibanserin 湖北大学 2019-01-18 CN claimed
US-9546141-B2 Salts SPROUT PHARMACEUTICALS, INC. (US) 2017-01-17 US claimed
US-20120322810-A9 NEW SALTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-20 US claimed
US-20120122883-A1 NEW SALTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-17 US claimed
EP-2376457-A2 CRYSTALLINE SALT FORMS OF FLIBANSERINE Boehringer Ingelheim International GmbH (DE) 2011-10-19 EP claimed
WO-2010146595-A2 NOVEL POLYMORPHS OF FLIBANSERIN HYDROCHLORIDE SYMED LABS LIMITED (IN) 2010-12-23 WO claimed
WO-2010079045-A2 NEW SALTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-15 WO claimed
CN-113683570-A New crystal form of flibanserin, preparation method and application thereof 孟晓明 2021-11-23 CN disclosed
US-20210308129-A1 TREATING SEXUAL DESIRE DISORDERS WITH FLIBANSERIN SPROUT PHARMACEUTICALS INC (US) 2021-10-07 US disclosed
US-11058683-B2 Treating sexual desire disorders with flibanserin SPROUT PHARMACEUTICALS, INC. (US) 2021-07-13 US disclosed
US-20210069185-A1 USE OF FLIBANSERIN IN THE TREATMENT OF OBESITY HOLLAND, ANNE 2021-03-11 US disclosed
US-10874668-B2 Use of Flibanserin in the treatment of obesity SPROUT PHARMACEUTICALS, INC. (US) 2020-12-29 US disclosed
US-20050239798-A1 Method for the treatment of premenstrual and other female sexual disorders BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-10-27 US disclosed
US-20040180904-A1 Novel use of 2h-benzimidazol-2-one, 1,3-Dihydro-1-(2{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)-and its physiologically acceptable addition salts BECK JURGEN K (DE) 2004-09-16 US disclosed
EP-1446122-A1 USE OF FLIBANSERIN IN THE TREATMENT OF SEXUAL DISORDERS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2004-08-18 EP disclosed
WO-2003035072-A1 USE OF FLIBANSERIN IN THE TREATMENT OF SEXUAL DISORDERS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-05-01 WO disclosed
WO-2002092088-A2 NOVEL USE OF 2H-BENZIMIDAZOL-2-ONE, 1,3-DIHADRO-1-(2{4-{3-(TRIFLUOROMETHYL}PHENYL]-1-PIPERAZINYL}ETHYL)- AND ITS PHYSIOLOGICALLY ACCEPTABLE ACID ADDITION SALTS BECK JUERGEN K (DE) 2002-11-21 WO disclosed
EP-1256343-A1 Flibanserin for the treatment of extrapyramidal movement disorders Beck, Jürgen K. Dr. (DE) 2002-11-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122883-A1 NEW SALTS FLNB, FLNA, SLC10A1 HTR1A 1165/4885ADRA2A 900/4885CHRM1 2278/4885
US-10874668-B2 Use of Flibanserin in the treatment of obesity FABP4, FLNB, GPR119 HTR1A 644/4885ADRA2A 800/4885CHRM1 1961/4885
US-20120322810-A9 NEW SALTS FLNB, FLNA, SLC10A1 HTR1A 1165/4885ADRA2A 900/4885CHRM1 2278/4885
US-20040180904-A1 Novel use of 2h-benzimidazol-2-one, 1,3-Dihydro-1-(2{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)-and its physiologically acceptable addition salts PARK7, IDO1, SNCA HTR1A 242/4885ADRA2A 1108/4885CHRM1 1140/4885
US-11058683-B2 Treating sexual desire disorders with flibanserin SLC6A3, FSHR, LPXN HTR1A 155/4885ADRA2A 351/4885CHRM1 1331/4885
US-20210069185-A1 USE OF FLIBANSERIN IN THE TREATMENT OF OBESITY FABP4, FLNB, GPR119 HTR1A 644/4885ADRA2A 800/4885CHRM1 1961/4885
US-20210308129-A1 TREATING SEXUAL DESIRE DISORDERS WITH FLIBANSERIN SLC6A3, FSHR, LPXN HTR1A 155/4885ADRA2A 351/4885CHRM1 1331/4885
US-20050239798-A1 Method for the treatment of premenstrual and other female sexual disorders FLNB, FSHR, CYP17A1 HTR1A 447/4885ADRA2A 1467/4885CHRM1 1476/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.