SCHEMBL5334782

SCHEMBL5334782

CNc1cc(-c2ccc(F)cc2F)c2nc(Nc3cc(CN4CCN(C)CC4)ccn3)sc2n1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 11/20 0.43
MET P08581 6/20 0.43
AXL P30530 3/20 0.41
KDR P35968 9/20 0.39

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
SCHEMBL5313556 0.92 MERTK (0.38) MERTKMETAXLKDR
SCHEMBL5314023 0.91 KDR (0.47) MERTKMETAXLKDR
SCHEMBL5333764 0.90 TNIK (0.41) MERTKKDR
SCHEMBL5311867 0.89 MERTK (0.45) MERTKMETAXL
SCHEMBL5329735 0.83 TNIK (0.41) MERTKMETAXLKDR
SCHEMBL5333643 0.83 KDR (0.46) KDR
SCHEMBL5335191 0.82 MAPK8 (0.39) MERTKMETKDR
SCHEMBL5333804 0.82 DRD4 (0.40) KDR
SCHEMBL5312320 0.81 KDR (0.49) KDR
SCHEMBL5310432 0.81 KDR (0.49) KDR

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-2007058482-A1 NOVEL INHIBITORS OF PROTEIN KINASE LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO claimed