SCHEMBL8563897

SCHEMBL8563897

O=C1Nc2ccccc2C(c2ccccc2)N1C1CCN(Cc2ccoc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.43
CHRM3 P20309 8/20 0.41
CHRM2 P08172 7/20 0.41
CHRM1 P11229 2/20 0.41
PARP2 Q9UGN5 1/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ACHE P22303 1/20 0.39
PARP1 P09874 2/20 0.39
CCR5 P51681 1/20 0.39
OPRM1 P35372 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL29445321 0.89 OPRL1 (0.52) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL6168606 0.89 OPRL1 (0.52) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL8569508 0.85 MEN1 (0.53) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL8565096 0.84 CCR5 (0.48) OPRL1CHRM3CHRM2ACHECCR5
SCHEMBL6168165 0.83 CHRM3 (0.49) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL8570369 0.83 CHRM3 (0.50) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL8568370 0.82 TRPV6 (0.48) OPRL1CHRM3CHRM2PARP2DRD2
SCHEMBL6167277 0.82 CHRM3 (0.53) OPRL1CHRM3CHRM2DRD2DRD4
SCHEMBL8570499 0.82 CHRM3 (0.55) CHRM3CHRM2DRD2DRD4DRD3
SCHEMBL8564439 0.82 CHRM2 (0.55) OPRL1CHRM3CHRM2DRD2DRD4

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