SCHEMBL4179280

SCHEMBL4179280

COCc1cc(Br)cn2nc(C(=O)N3CCc4ccccc4[C@H]3C)cc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 2/20 0.41
TRPC6 Q9Y210 2/20 0.41
DRD1 P21728 1/20 0.40
RIPK1 Q13546 1/20 0.39
GRM5 P41594 5/20 0.38
SPR P35270 3/20 0.38
KRAS P01116 3/20 0.37
PARP1 P09874 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
PRMT5 O14744 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
SCHEMBL4183682 0.90 TRPC3 (0.43) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL3821054 0.86 HTT (0.45) TRPC3TRPC6RIPK1GRM5LMNA
SCHEMBL3812898 0.86 HTT (0.45) TRPC3TRPC6RIPK1GRM5LMNA
SCHEMBL3816778 0.86 TRPC3 (0.43) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL3814941 0.86 TRPC3 (0.43) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL4022777 0.84 TRPC3 (0.42) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL4025530 0.82 TRPC3 (0.41) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL3819293 0.81 TRPC3 (0.40) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL3814391 0.81 TRPC3 (0.40) TRPC3TRPC6DRD1RIPK1GRM5
SCHEMBL3816775 0.79 TRPC3 (0.44) TRPC3TRPC6DRD1RIPK1GRM5

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