SCHEMBL3863140

SCHEMBL3863140

Nc1ccc2c(c1)CCN=C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPT P10636 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GAA P10253 2/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ F2 P00734 1/20 0.30
▸ CHRM2 P08172 1/20 0.30
▸ HTR1A P08908 1/20 0.30
▸ ADRA2A P08913 1/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30

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
SCHEMBL29769963 1.00 CASP1 (0.37) CASP1CASP7HSD17B10MAPTLMNA
SCHEMBL7659749 0.84 MEN1 (0.34) CASP1CASP7HSD17B10MAPTLMNA
SCHEMBL7938077 0.76 ADRA2A (0.34) MAPTKDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL1962410 0.76 PNMT (0.36) ADRA2A
SCHEMBL9573469 0.76 DRD2 (0.37) HSD17B10CA9MAOADRD1DRD3
SCHEMBL9573203 0.76 CYP19A1 (0.33) KMT2AADRA2AACHESLC6A4
SCHEMBL30025550 0.76 ADRA2A (0.34) MAPTKDM4EALDH1A1RAB9ASMN1; SMN2
SCHEMBL28191945 0.76 — —
SCHEMBL9573205 0.76 HTR2A (0.38) ADRA2AACHEHTT
Hydrochloric Acid SCHEMBL11820690 0.74 ADRA2A (0.33) ALDH1A1ADRA2AACHE

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009135927-A1 SUBSTITUTED N-PHENYL-2,3-DIHYDROIMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-11-12 — — WO claimed
WO-2009135925-A1 SUBSTITUTED N-IMIDAZO[2,1-B]THIAZOLE-5-SULFONAMIDE DERIVATIVES AS 5-HT6 LIGANDS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-11-12 — — WO claimed
EP-2116547-A1 Substituted N-imidazo(2, 1-b) thiazole-5-sulfonamide derivatives as 5-TH6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 — — EP claimed
EP-2116546-A1 Substituted N-phenyl-2,3-dihydroimidazo[2,1-b]thiazole-5-sulfonamide derivatives as 5-HT6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 — — EP claimed
CN-110049977-A As the lactams of potent and selective ROCK inhibitor, cyclic annular urea and carbamate and triazolone derivative 百时美施贵宝公司 2019-07-23 — — CN disclosed
CN-109843888-A 6, 7, 8, 9-tetrahydro-3H-pyrazolo [4, 3-f ] isoquinoline derivatives useful for the treatment of cancer 阿斯利康(瑞典)有限公司 2019-06-04 — — CN disclosed
CN-106065009-B Application as the compound of hepatitis c inhibitor and its in drug 广东东阳光药业有限公司 2019-03-01 — — CN disclosed
CN-109311874-A The bicyclic heterocyclic compounds being substituted 百时美施贵宝公司 2019-02-05 — — CN disclosed
CN-108495850-A Oxopyridine amide derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2018-09-04 — — CN disclosed
CN-108473471-A Substituted thiourocystine derivatives as androgen receptor antagonists 詹森药业有限公司 2018-08-31 — — CN disclosed
CN-107253963-A Pyridone and azepine pyridinone compounds and application method 吉利德康涅狄格有限公司 2017-10-17 — — CN disclosed
CN-103717597-B Heterocyclic compounds as kinase inhibitors 原真股份有限公司 2017-07-04 — — CN disclosed
CN-103038233-B Pyridone and azapyridone compounds and methods of use 吉利德康涅狄格有限公司 2017-06-20 — — CN disclosed
CN-101663278-A Compounds and compositions as modulators of GPR119 activity IRM LLC 2010-03-03 — — CN disclosed
EP-2116547-A1 Substituted N-imidazo(2, 1-b) thiazole-5-sulfonamide derivatives as 5-TH6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 — — EP disclosed
EP-2116546-A1 Substituted N-phenyl-2,3-dihydroimidazo[2,1-b]thiazole-5-sulfonamide derivatives as 5-HT6 ligands Laboratorios Del. Dr. Esteve, S.A. (ES) 2009-11-11 — — EP disclosed
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