SCHEMBL6166931

SCHEMBL6166931

COCc1cccc(CN2CCC(N3C(=O)Nc4ccccc4C3c3ccccc3)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 9/20 0.43
CHRM2 P08172 7/20 0.43
OPRL1 P41146 2/20 0.42
CCR8 P51685 1/20 0.41
OPRM1 P35372 2/20 0.41
DRD2 P14416 4/20 0.41
DRD4 P21917 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL6167620 0.94 CHRM3 (0.41) CHRM3CHRM2OPRL1CCR8OPRM1
SCHEMBL6167614 0.93 CHRM2 (0.44) CHRM3CHRM2OPRL1CCR8OPRM1
SCHEMBL6167790 0.93 CHRM2 (0.43) CHRM3CHRM2OPRL1CCR8OPRM1
SCHEMBL6165720 0.93 CHRM3 (0.47) CHRM3CHRM2CCR8OPRM1DRD2
SCHEMBL6169679 0.92 CHRM3 (0.48) CHRM3CHRM2CCR8OPRM1DRD2
SCHEMBL6168017 0.92 CHRM2 (0.44) CHRM3CHRM2CCR8OPRM1MEN1
SCHEMBL6170271 0.92 CHRM2 (0.45) CHRM3CHRM2OPRL1OPRM1DRD2
SCHEMBL6169683 0.91 MEN1 (0.48) CHRM3CHRM2OPRM1DRD2DRD4
SCHEMBL8570520 0.89 OPRL1 (0.45) CHRM3CHRM2OPRL1OPRM1DRD2
SCHEMBL6167793 0.89 CCR8 (0.41) CHRM3CHRM2OPRL1CCR8OPRM1

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-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