SCHEMBL8570359

SCHEMBL8570359

COc1cccc(CN2CCC(N3C(=O)Nc4ccccc4C3c3cccc(OCc4ccccc4)c3)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.51
CHRM2 P08172 1/20 0.51
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.48
OPRM1 P35372 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
KDM4E B2RXH2 3/20 0.45
LMNA P02545 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
PDE5A O76074 1/20 0.44
PDE11A Q9HCR9 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
OPRL1 P41146 1/20 0.43
ALDH1A1 P00352 2/20 0.43

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
SCHEMBL6166416 0.93 CHRM3 (0.52) CHRM3CHRM2DRD2DRD4OPRM1
Hydrochloric Acid SCHEMBL6168628 0.92 CHRM3 (0.52) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL8565700 0.92 CHRM3 (0.56) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL6169679 0.90 CHRM3 (0.48) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL8567234 0.90 CHRM2 (0.50) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL8571599 0.87 CHRM3 (0.46) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL5113815 0.85 FAAH (0.47) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL6166931 0.83 CHRM3 (0.43) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL5103283 0.83 CHRM3 (0.46) CHRM3CHRM2DRD2DRD4OPRM1
SCHEMBL8570499 0.83 CHRM3 (0.55) CHRM3CHRM2DRD2DRD4OPRM1

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