Nisoxetine

Nisoxetine

SCHEMBL29440249

CNCCC(Oc1ccccc1OC)c1ccccc1.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 Nisoxetine. 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
▸ SLC6A2 known ✓ P23975 10/20 1.00
▸ SLC6A4 known ✓ P31645 13/20 0.97
▸ SLC6A3 known ✓ Q01959 3/20 0.97
▸ CHRM1 known ✓ P11229 2/20 0.71
▸ ADRA2B known ✓ P18089 2/20 0.71
▸ HTR2A known ✓ P28223 2/20 0.71
▸ HTR2C known ✓ P28335 2/20 0.71
▸ HRH1 known ✓ P35367 2/20 0.71
▸ OPRM1 known ✓ P35372 2/20 0.71
▸ DRD3 known ✓ P35462 2/20 0.71
▸ OPRK1 known ✓ P41145 2/20 0.71
▸ HTR2B known ✓ P41595 2/20 0.71
▸ KCNH2 known ✓ Q12809 2/20 0.71
▸ HRH3 known ✓ Q9Y5N1 2/20 0.71
▸ PMP22 Q01453 2/20 1.00
▸ CYP2D6 P10635 5/20 0.97
▸ CYP1A2 P05177 4/20 0.97
▸ CYP3A4 P08684 4/20 0.97
▸ TSHR P16473 3/20 0.97
▸ KMT2A Q03164 2/20 0.97

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
Nisoxetine SCHEMBL467262 1.00 SLC6A2 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL30026153 0.98 SLC6A4 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL124289 0.98 SLC6A4 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL29401038 0.98 SLC6A4 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL3897550 0.98 SLC6A4 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL3892886 0.98 SLC6A4 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL14973458 0.95 SLC6A4 (0.94) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Nisoxetine SCHEMBL4083146 0.92 SLC6A4 (0.86) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
[3H]Nisoxetine SCHEMBL29463855 0.88 SLC6A2 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2
Atomoxetine SCHEMBL1560986 0.85 SLC6A2 (1.00) SLC6A2PMP22SLC6A4CYP2D6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4704826-A1 COMPOSITIONS AND METHODS FOR TREATING POST-TRAUMATIC STRESS DISORDER Yale University (US) 2026-03-11 — — EP claimed
WO-2024226995-A1 COMPOSITIONS AND METHODS FOR TREATING POST-TRAUMATIC STRESS DISORDER YALE UNIVERSITY (US) 2024-10-31 — — WO claimed
US-20230381168-A1 ADJUNCTIVE THERAPY FOR DEPRESSION ANEUROTECH BV (BE) 2023-11-30 — — US claimed
US-20260098053-A1 COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS SAGE THERAPEUTICS INC (US) 2026-04-09 — — US disclosed
US-20260083709-A1 COMBINATION PHARMACOLOGICAL INTERVENTIONS FOR MULTIPLE MECHANISMS OF OBSTRUCTIVE SLEEP APNEA APNIMED INC DELAWARE (US) 2026-03-26 — — US disclosed
EP-4704826-A1 COMPOSITIONS AND METHODS FOR TREATING POST-TRAUMATIC STRESS DISORDER Yale University (US) 2026-03-11 — — EP disclosed
EP-3976628-B1 NEUROACTIVE STEROIDS AND COMPOSITIONS THEREOF SAGE THERAPEUTICS LLC (US) 2026-03-04 — — EP disclosed
US-12558327-B2 Methods and compositions for treating sleep apnea THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2026-02-24 — — US disclosed
US-12552829-B2 Compositions and methods for treating CNS disorders SAGE THERAPEUTICS, INC. (US) 2026-02-17 — — US disclosed
US-20260027070-A1 METHODS AND COMPOSITIONS FOR TREATING SLEEP APNEA APNIMED INC DELAWARE (US) 2026-01-29 — — US disclosed
US-20260022091-A1 POLYMORPHIC FORMS OF (R)-OXYBUTYNIN HYDROCHLORIDE APNIMED INC DELAWARE (US) 2026-01-22 — — US disclosed
CN-114729000-A Compounds for the treatment of CNS disorders 萨奇治疗股份有限公司 2022-07-08 — — CN disclosed
WO-2022115381-A1 COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS CROSS REFERENCE TO RELATED APPLICATION SAGE THERAPEUTICS, ONC. (US) 2022-06-02 — — WO disclosed
EP-3990469-A1 COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS Sage Therapeutics, Inc. (US) 2022-05-04 — — EP disclosed
EP-3990468-A1 COMPOUNDS FOR TREATING CNS DISORDERS Sage Therapeutics, Inc. (US) 2022-05-04 — — EP disclosed
EP-3990467-A1 COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS Sage Therapeutics, Inc. (US) 2022-05-04 — — EP disclosed
CN-114391019-A Compositions and methods for treating CNS disorders 萨奇治疗股份有限公司 2022-04-22 — — CN disclosed
EP-3976628-A1 NEUROACTIVE STEROIDS AND COMPOSITIONS THEREOF Sage Therapeutics, Inc. (US) 2022-04-06 — — EP disclosed
US-20220096401-A1 METHODS AND COMPOSITIONS FOR TREATING SLEEP APNEA NATIONAL INSTITUTES OF HEALTH 2022-03-31 — — US disclosed
CN-114206900-A Neuroactive steroids and compositions thereof 萨奇治疗股份有限公司 2022-03-18 — — CN 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 (7 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-20260027070-A1 METHODS AND COMPOSITIONS FOR TREATING SLEEP APNEA NTSR1, NTSR2, GPR39 SLC6A2 6/4885SLC6A4 13/4885SLC6A3 96/4885
US-12558327-B2 Methods and compositions for treating sleep apnea ADRA2A, HTR2A, ADRA2B SLC6A2 4/4885SLC6A4 31/4885SLC6A3 62/4885
US-20260083709-A1 COMBINATION PHARMACOLOGICAL INTERVENTIONS FOR MULTIPLE MECHANISMS OF OBSTRUCTIVE SLEEP APNEA CHRNA2, CHRNA3, ADRA2B SLC6A2 4/4885SLC6A4 85/4885SLC6A3 69/4885
US-20260022091-A1 POLYMORPHIC FORMS OF (R)-OXYBUTYNIN HYDROCHLORIDE CHRNB1, CHRM2, CHRND SLC6A2 357/4885SLC6A4 1972/4885SLC6A3 1964/4885
US-20260098053-A1 COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS GRIN2B, GRIN2C, GRIN2D SLC6A2 30/4885SLC6A4 59/4885SLC6A3 24/4885
US-12552829-B2 Compositions and methods for treating CNS disorders GRIN2C, GRIN2B, GRIN2A SLC6A2 122/4885SLC6A4 561/4885SLC6A3 161/4885
US-20230381168-A1 ADJUNCTIVE THERAPY FOR DEPRESSION HTR2A, HTR3B, HTR5A SLC6A2 44/4885SLC6A4 25/4885SLC6A3 30/4885

“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.

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