SCHEMBL3347237

SCHEMBL3347237

Cc1cc2nc(OCC#Cc3ccccn3)ccn2n1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.46
ALOX5 P09917 1/20 0.37
PDE10A Q9Y233 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
SCHEMBL3345981 0.87 GRM5 (0.52) GRM5
SCHEMBL3345895 0.85 CA12 (0.35) GRM5ALOX5PDE10A
SCHEMBL3347174 0.83 ALOX5 (0.36) GRM5ALOX5
SCHEMBL3347189 0.83 GRM5 (0.34) GRM5
SCHEMBL3346372 0.83 GRM5 (0.40) GRM5PDE10A
SCHEMBL3348468 0.82 GRM5 (0.45) GRM5ALOX5PDE10A
SCHEMBL3347064 0.81 GRM5 (0.39) GRM5
SCHEMBL3345574 0.81 GRM5 (0.34) GRM5
SCHEMBL3347334 0.81 GRM5 (0.37) GRM5
SCHEMBL3347152 0.80 CHRNB2 (0.41) GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO claimed
WO-2010063487-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-06-10 WO disclosed