SCHEMBL6164725

SCHEMBL6164725

O=C1Nc2ccccc2C(c2ccccc2)N1C1CCN(CC2CCCCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.50
OPRL1 P41146 10/20 0.48
OPRM1 P35372 9/20 0.48
OPRK1 P41145 7/20 0.48
OPRD1 P41143 2/20 0.46
DRD2 P14416 2/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
PARP1 P09874 1/20 0.45
CCR5 P51681 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
CCR1 P32246 4/20 0.42

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
Hydrochloric Acid SCHEMBL6166889 0.99 CHRM3 (0.49) CHRM3OPRL1OPRM1OPRK1OPRD1
SCHEMBL6168102 0.94 CHRM3 (0.42) CHRM3OPRL1OPRM1OPRK1OPRD1
SCHEMBL8569662 0.86 PARP1 (0.49) CHRM3PARP1
Hydrochloric Acid SCHEMBL6169543 0.85 PARP1 (0.48) CHRM3PARP1
SCHEMBL6168606 0.84 OPRL1 (0.52) CHRM3OPRL1OPRM1OPRK1DRD2
SCHEMBL8564971 0.84 TACR1 (0.43) OPRL1OPRM1OPRK1DRD2DRD4
SCHEMBL29445321 0.84 OPRL1 (0.52) CHRM3OPRL1OPRM1OPRK1DRD2
SCHEMBL8566631 0.84 OPRM1 (0.49) CHRM3OPRL1OPRM1OPRK1OPRD1
SCHEMBL8565908 0.82 TACR1 (0.41) CHRM3OPRL1CCR5
SCHEMBL8567952 0.82 SLC18A3 (0.49) OPRL1OPRM1SIGMAR1

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