SCHEMBL8028681

SCHEMBL8028681

CCC1Cc2ccccc2C(C)N1C

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.46
▸ OPRM1 P35372 8/20 0.45
▸ OPRK1 P41145 3/20 0.41
▸ OPRD1 P41143 1/20 0.39
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.38
▸ HTR1A P08908 2/20 0.37

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
SCHEMBL12159092 0.79 PRCP (0.38) PRCPOPRM1
SCHEMBL10481214 0.75 ALDH1A1 (0.39) PRCPOPRM1
SCHEMBL8727145 0.70 ACE (0.44) OPRM1
SCHEMBL10193173 0.69 MTNR1A (0.46) —
SCHEMBL13452979 0.69 OPRM1 (0.49) OPRM1SIGMAR1
SCHEMBL13155623 0.69 OPRM1 (0.49) OPRM1SIGMAR1
SCHEMBL14135549 0.69 OPRM1 (0.49) OPRM1SIGMAR1
SCHEMBL19337132 0.69 MTNR1A (0.46) —
SCHEMBL13014907 0.68 GPR3 (0.46) PRCPOPRM1OPRK1
SCHEMBL11883759 0.67 HTR2A (0.46) SIGMAR1

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-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 — — WO disclosed
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