SCHEMBL16332856

SCHEMBL16332856

COc1ccc(Nc2cc3c(cn2)nc(Nc2ccccc2)n3C)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 2/20 0.50
▸ PDGFRA P16234 2/20 0.50
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ CSNK2A1 P68400 1/20 0.46
▸ SHMT2 P34897 1/20 0.46
▸ IGF1R P08069 1/20 0.45
▸ MAPK8 P45983 1/20 0.45
▸ MAPK9 P45984 1/20 0.45
▸ PLK1 P53350 1/20 0.44
▸ BRAF P15056 1/20 0.44
▸ ABCG2 Q9UNQ0 3/20 0.42
▸ KDR P35968 2/20 0.42
▸ ABCB1 P08183 2/20 0.42
▸ ABCC1 P33527 2/20 0.42
▸ LCK P06239 1/20 0.42
▸ MAPK14 Q16539 1/20 0.42
▸ FLT1 P17948 1/20 0.42
▸ FLT4 P35916 1/20 0.42
▸ AURKA O14965 1/20 0.42

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
SCHEMBL16332219 0.87 FGFR1 (0.49) PDGFRBPDGFRANPC1RAB9ABRAF
SCHEMBL16332523 0.84 SMN1; SMN2 (0.54) PDGFRBPDGFRANPC1RAB9ASMN1; SMN2
SCHEMBL16331671 0.82 RAB9A (0.53) RAB9ASMN1; SMN2LMNAALDH1A1HTT
SCHEMBL16331602 0.82 FLT3 (0.44) PDGFRBPDGFRANPC1RAB9ASHMT2
SCHEMBL16331647 0.81 FGFR1 (0.48) PDGFRBPDGFRANPC1RAB9ABRAF
SCHEMBL16333060 0.81 PIK3CA (0.50) PLK1ABCG2KDRPIK3CAPRKDC
SCHEMBL16332041 0.79 PDE10A (0.44) PDGFRBPDGFRACSNK2A1BRAFFYN
SCHEMBL16332345 0.79 RAB9A (0.46) NPC1RAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL16332845 0.79 PIK3CA (0.51) NPC1RAB9AFYNPIK3CAPRKDC
SCHEMBL16332134 0.78 SMN1; SMN2 (0.52) PDGFRBPDGFRANPC1RAB9ASMN1; SMN2

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-2818472-A1 Imidazo[4,5-c]pyridine and pyrrolo[3,2-c]pyridine compounds as G-protein-coupled receptor kinase 5 (GRK5) modulators Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-12-31 — — EP claimed
EP-2818472-A1 Imidazo[4,5-c]pyridine and pyrrolo[3,2-c]pyridine compounds as G-protein-coupled receptor kinase 5 (GRK5) modulators Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-12-31 — — EP disclosed
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