SCHEMBL8564971

SCHEMBL8564971

CCN1CCC(N2C(=O)Nc3ccccc3C2c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.43
OPRL1 P41146 5/20 0.42
OPRM1 P35372 4/20 0.42
PRCP P42785 1/20 0.39
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
SRC P12931 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCZ Q05513 1/20 0.38
PRKCD Q05655 1/20 0.38
CAMK2B Q13554 1/20 0.38
CAMK2G Q13555 1/20 0.38
CAMK2D Q13557 1/20 0.38
CAMK2A Q9UQM7 1/20 0.38
PDE6D O43924 5/20 0.37
ALDH1A1 P00352 1/20 0.37
OPRK1 P41145 2/20 0.36
MEN1 O00255 1/20 0.36

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 0.88 OPRL1 (0.52) OPRL1OPRM1OPRK1MEN1KMT2A
SCHEMBL6168606 0.88 OPRL1 (0.52) OPRL1OPRM1OPRK1MEN1KMT2A
SCHEMBL6168284 0.87 TACR1 (0.41) TACR1OPRL1OPRM1PDE6DMEN1
SCHEMBL6168102 0.87 CHRM3 (0.42) TACR1OPRL1OPRM1PRKCGPRKCB
SCHEMBL8564042 0.86 CHRM2 (0.43) TACR1PRCPALDH1A1MEN1KMT2A
SCHEMBL8565908 0.86 TACR1 (0.41) TACR1OPRL1ALDH1A1MEN1KMT2A
SCHEMBL8567952 0.86 SLC18A3 (0.49) TACR1OPRL1OPRM1PDE6D
SCHEMBL8568996 0.85 KDM1A (0.49) TACR1PDE6DMEN1KMT2ADRD2
SCHEMBL8571710 0.85 PRCP (0.42) TACR1OPRL1PRCPPDE6DALDH1A1
SCHEMBL8571012 0.85 CHRM2 (0.49) OPRL1MEN1KMT2ADRD2DRD4

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