SCHEMBL4392192

SCHEMBL4392192

COc1ccnc2c1ccn2Br

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
EGFR P00533 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
GRM1 Q13255 3/20 0.35
SLC40A1 Q9NP59 1/20 0.34
CGAS Q8N884 1/20 0.34
CYP17A1 P05093 1/20 0.34
CYP1A2 P05177 1/20 0.34
NCF1 P14598 1/20 0.33

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
SCHEMBL12354936 0.79 CDK5 (0.38) PDGFRBPDGFRACDK5CDK5R1GRM1
SCHEMBL27872053 0.76 MAPT (0.38) PDGFRBPDGFRAGRM1
SCHEMBL31347172 0.72 PSMD14 (0.46) SLC40A1CYP1A2
SCHEMBL2086330 0.68 HTR6 (0.61) SLC40A1
SCHEMBL1778592 0.67 L3MBTL1 (0.56)
SCHEMBL2280415 0.66 ELANE (0.42) CDK5CDK5R1
SCHEMBL185654 0.66 CCR1 (0.50) PDGFRBPDGFRASLC40A1
SCHEMBL22533539 0.66 UBE2N (0.39) GRM1
SCHEMBL828159 0.63 GAK (0.55) NCF1
SCHEMBL4400367 0.63 PDGFRB (0.72) PDGFRBPDGFRAEGFR

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
EP-2056822-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-05-13 EP disclosed
WO-2008150914-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-12-11 WO disclosed