Diphenylacetic Acid

Diphenylacetic Acid

SCHEMBL418537

Cl.O=C(O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.59

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 Diphenylacetic Acid. 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
SRC known ✓ P12931 2/20 0.59
HDAC3 known ✓ O15379 1/20 0.56
HDAC4 known ✓ P56524 1/20 0.56
HDAC1 known ✓ Q13547 1/20 0.56
HDAC7 known ✓ Q8WUI4 1/20 0.56
HDAC2 known ✓ Q92769 1/20 0.56
HDAC10 known ✓ Q969S8 1/20 0.56
HDAC11 known ✓ Q96DB2 1/20 0.56
HDAC8 known ✓ Q9BY41 1/20 0.56
HDAC6 known ✓ Q9UBN7 1/20 0.56
HDAC9 known ✓ Q9UKV0 1/20 0.56
HDAC5 known ✓ Q9UQL6 1/20 0.56
CHRM1 known ✓ P11229 1/20 0.47
PTGS1 known ✓ P23219 1/20 0.47
ADRA1A known ✓ P35348 1/20 0.47
GAA known ✓ P10253 2/20 0.45
HSD11B1 known ✓ P28845 1/20 0.45
CYP2D6 P10635 1/20 0.59
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58

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
Diphenylacetic Acid SCHEMBL38022 0.97 SRC (0.62) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL8513250 0.97 SRC (0.62) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL28446280 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL30803718 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL27858509 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL8411440 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL6852183 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL9750917 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL9485695 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA
Diphenylacetic Acid SCHEMBL27841008 0.94 SRC (0.59) SRCCYP2D6TDP1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100035954-A1 ACID ADDITION SALTS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES INC. (IN) 2010-02-11 US claimed
EP-1828126-A1 ACID ADDITION SALTS OF MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-09-05 EP claimed
WO-2006064304-A1 ACID ADDITION SALTS OF MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-06-22 WO claimed
EP-3019477-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2021-05-26 EP disclosed
CN-107051000-A A kind of water proof material and its manufacture method and application 徐州工程学院 2017-08-18 CN disclosed
CN-107051000-A A kind of water proof material and its manufacture method and application 徐州工程学院 2017-08-18 CN disclosed
US-9714224-B2 Heterocyclic compounds and methods of their use NOVARTIS AG (CH) 2017-07-25 US disclosed
EP-3081557-A1 SALT AND SOLVATES OF A TETRAHYDROISOQUINOLINE DERIVATIVE Novartis AG (CH) 2016-10-19 EP disclosed
CN-105777636-A SALT AND SOLVATES OF A TETRAHYDROISOQUINOLINE DERIVATIVE 诺华股份有限公司 2016-07-20 CN disclosed
US-20160145213-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF THEIR USE SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2016-05-26 US disclosed
CN-103003244-B Salts and solvates of tetrahydroisoquinoline derivatives NOVARTIS AG (CH) 2016-04-20 CN disclosed
EP-0923570-A1 PYRIDYL ALKENE- AND PYRIDYL ALKINE- ACID AMIDES AS CYTOSTATICS AND IMMUNOSUPPRESSIVES Klinge Pharma GmbH (DE) 1999-06-23 EP disclosed
WO-1997048696-A1 PYRIDYL ALKENE- AND PYRIDYL ALKINE- ACID AMIDES AS CYTOSTATICS AND IMMUNOSUPPRESSIVES KLINGE PHARMA GMBH (DE) 1997-12-24 WO disclosed
US-4225617-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1980-09-30 US disclosed
US-4209524-A CENTRAL NERVOUS SYSTEM LABORATOIRE L. LAFON (FR) 1980-06-24 US disclosed
US-4209523-A TREATMENT OF THE CENTRAL NERVOUS SYSTEM LABORATOIRE L. LAFON (FR) 1980-06-24 US disclosed
US-4183951-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1980-01-15 US disclosed
US-4152458-A CENTRAL NERVOUS SYSTEM, PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1979-05-01 US disclosed
US-4151300-A CENTRAL NERVOUS SYSTEM, PSYCHOTROPIC LABORATOIRE L. LAFON (FR) 1979-04-24 US disclosed
US-4122186-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1978-10-24 US 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 (2 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-20100035954-A1 ACID ADDITION SALTS OF MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 SRC 2539/4885HDAC3 3076/4885HDAC4 2708/4885
US-20160145213-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF THEIR USE AGTR2, AGTR1, AGT SRC 873/4885HDAC3 984/4885HDAC4 2572/4885

“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.