SCHEMBL6164748

SCHEMBL6164748

O=C1Nc2ccccc2C(c2ccccc2)N1C1CCN(Cc2cccc(CO)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.44
CHRM3 P20309 11/20 0.43
CHRM2 P08172 10/20 0.43
DRD2 P14416 1/20 0.42
KDM1A O60341 1/20 0.41
ACHE P22303 1/20 0.41
CHRM1 P11229 1/20 0.41
OPRM1 P35372 3/20 0.41
PARP1 P09874 1/20 0.40
OPRK1 P41145 1/20 0.40

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
SCHEMBL6168606 0.91 OPRL1 (0.52) OPRL1CHRM3CHRM2DRD2ACHE
SCHEMBL29445321 0.91 OPRL1 (0.52) OPRL1CHRM3CHRM2DRD2ACHE
SCHEMBL8571871 0.90 CHRM3 (0.54) OPRL1CHRM3CHRM2DRD2KDM1A
SCHEMBL8570520 0.90 OPRL1 (0.45) OPRL1CHRM3CHRM2DRD2ACHE
SCHEMBL8564439 0.89 CHRM2 (0.55) OPRL1CHRM3CHRM2DRD2OPRM1
SCHEMBL8562694 0.88 KDM1A (0.56) OPRL1KDM1A
SCHEMBL5100221 0.88 OPRL1 (0.44) OPRL1CHRM3CHRM2DRD2ACHE
SCHEMBL8569557 0.88 CHRM2 (0.54) OPRL1CHRM3CHRM2DRD2ACHE
SCHEMBL8562946 0.88 CHRM3 (0.54) OPRL1CHRM3CHRM2ACHECHRM1
SCHEMBL8565541 0.88 CHRM2 (0.54) OPRL1CHRM3CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1122253-B1 QUINAZOLINONE DERIVATIVES SUMITOMO PHARMA (JP) 2005-08-17 EP disclosed
US-6645971-B1 Pollakiuria and urinary incontinence treatment; muscarinic receptor antagonists; anticholinergic, anticonvulsants, antiulcer, and antiasthmatics; Parkinson*s disease SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2003-11-11 US disclosed
EP-1122253-A1 QUINAZOLINONE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-08-08 EP disclosed
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