SCHEMBL16331385

SCHEMBL16331385

CNc1nc2cnc(Nc3ccc(N4CCN(C)CC4)cc3)cc2n1CC1CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 4/20 0.49
▸ FLT3 P36888 2/20 0.49
▸ EGFR P00533 6/20 0.45
▸ SRC P12931 2/20 0.45
▸ FGFR1 P11362 1/20 0.45
▸ GABRG2 P18507 3/20 0.44
▸ GABRB3 P28472 3/20 0.44
▸ GABRA5 P31644 3/20 0.44
▸ KDR P35968 2/20 0.44
▸ JAK2 O60674 1/20 0.44
▸ ERBB2 P04626 1/20 0.44
▸ MET P08581 1/20 0.44
▸ KIT P10721 1/20 0.44
▸ PRKCA P17252 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ TYK2 P29597 1/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ PRKCQ Q04759 1/20 0.44
▸ KARS1 Q15046 1/20 0.44

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
SCHEMBL16332414 0.91 GABRG2 (0.54) EGFRSRCFGFR1GABRG2GABRB3
SCHEMBL16332664 0.81 GABRG2 (0.55) FLT3EGFRGABRG2GABRB3GABRA5
SCHEMBL16332413 0.78 RHOA (0.47) EGFRGABRG2GABRB3GABRA5
SCHEMBL16332798 0.76 GABRG2 (0.46) FLT3EGFRSRCFGFR1GABRG2
SCHEMBL16331646 0.76 GABRG2 (0.46) EGFRSRCGABRG2GABRB3GABRA5
SCHEMBL16331388 0.75 BRD4 (0.51) FYNFLT3EGFRSRCFGFR1
SCHEMBL16332930 0.75 GABRG2 (0.68) GABRG2GABRB3GABRA5
SCHEMBL16332751 0.73 IGF1R (0.44) FYNEGFRSRCFGFR1GABRG2
SCHEMBL16332276 0.72 GABRG2 (0.67) GABRG2GABRB3GABRA5MAPK9
SCHEMBL16332447 0.72 PIK3CA (0.58) GABRG2GABRB3GABRA5MAPK9

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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