SCHEMBL14543172

SCHEMBL14543172

CCN1CCC(N2C(=O)Cc3ccccc32)CC1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 16/20 0.71
OPRL1 P41146 15/20 0.71
OPRK1 P41145 15/20 0.71
HTR2A P28223 1/20 0.58
HTR7 P34969 1/20 0.58
KCNH2 Q12809 1/20 0.56

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
SCHEMBL10316251 0.85 OPRM1 (0.69) OPRM1OPRL1OPRK1
SCHEMBL181682 0.83 OPRM1 (1.00) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL2554375 0.83 OPRM1 (0.69) OPRM1OPRL1OPRK1
SCHEMBL1859950 0.81 OPRM1 (1.00) OPRM1OPRL1OPRK1HTR2AHTR7
SCHEMBL14542901 0.81 OPRM1 (0.70) OPRM1OPRL1OPRK1
SCHEMBL12219050 0.80 OPRM1 (0.63) OPRM1OPRL1OPRK1
SCHEMBL11930767 0.80 OPRM1 (0.76) OPRM1OPRL1OPRK1
SCHEMBL28667548 0.80 OPRM1 (0.80) OPRM1OPRL1OPRK1
SCHEMBL9837438 0.80 OPRM1 (0.75) OPRM1OPRL1OPRK1
SCHEMBL1864606 0.79 OPRM1 (0.66) OPRM1OPRL1OPRK1HTR2AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007044441-A2 USE OF PYRAZOLO [1 , 5 -A] PYRIMIDINE DERIVATIVES FOR INHIBITING PROTEIN KINASES METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-04-19 WO disclosed