SCHEMBL8570338

SCHEMBL8570338

O=C1Nc2ccccc2C(c2ccccc2)N1C1CCN(C2CCOCC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.45
CHRM4 P08173 2/20 0.45
CHRM1 P11229 2/20 0.45
KDM1A O60341 4/20 0.40
MAOB P27338 1/20 0.40
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
OPRL1 P41146 3/20 0.38
OPRM1 P35372 3/20 0.37
OPRD1 P41143 3/20 0.37
OPRK1 P41145 3/20 0.37
OGFRL1 Q5TC84 2/20 0.37
CHRM5 P08912 1/20 0.37
CHRM3 P20309 1/20 0.37
KCNH2 Q12809 1/20 0.37
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PARP1 P09874 1/20 0.35
SLC18A3 Q16572 1/20 0.35
TACR1 P25103 1/20 0.35

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
SCHEMBL8566631 0.88 OPRM1 (0.49) CHRM2CHRM4CHRM1ALDH1A1OPRL1
SCHEMBL8564042 0.82 CHRM2 (0.43) CHRM2KDM1AMAOBALDH1A1KMT2A
SCHEMBL5103372 0.79 SLC18A3 (0.40) KDM1AMAOBALDH1A1KMT2AOPRD1
SCHEMBL8564971 0.79 TACR1 (0.43) ALDH1A1KMT2AOPRL1OPRM1OPRK1
SCHEMBL29445321 0.79 OPRL1 (0.52) CHRM2KMT2AOPRL1OPRM1OPRK1
SCHEMBL6168606 0.79 OPRL1 (0.52) CHRM2KMT2AOPRL1OPRM1OPRK1
Hydrochloric Acid SCHEMBL8571208 0.78 KDM1A (0.40) KDM1AMAOBALDH1A1KMT2AOPRD1
SCHEMBL6168102 0.78 CHRM3 (0.42) OPRL1OPRM1OPRD1OPRK1CHRM3
SCHEMBL8565908 0.77 TACR1 (0.41) CHRM2KDM1AALDH1A1KMT2AOPRL1
SCHEMBL8567952 0.77 SLC18A3 (0.49) KDM1AOPRL1OPRM1SLC18A3TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626373-B1 Quinazolinone derivatives SUMITOMO PHARMA (JP) 1998-12-23 EP disclosed
US-5556860-A ANTIISCHEMIC AGENTS, BRAIN DISORDERS AND BLOOD METAL CONCENTRATIONS AND KIDNEY DISEASE SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1996-09-17 US disclosed
EP-0626373-A1 Quinazolinone derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-30 EP disclosed