SCHEMBL16332000

SCHEMBL16332000

CNc1nc2cnc(Nc3cccc(F)c3)cc2n1-c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 6/20 0.53
▸ EGFR P00533 3/20 0.40
▸ ERBB2 P04626 1/20 0.40
▸ ACVR1 Q04771 1/20 0.39
▸ LCK P06239 3/20 0.39
▸ TP53 P04637 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KDR P35968 2/20 0.38
▸ MAPK14 Q16539 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PTK2 Q05397 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ IGF1R P08069 1/20 0.36
▸ PDGFRB P09619 1/20 0.36
▸ PDGFRA P16234 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
SCHEMBL16331865 0.91 BRAF (0.51) BRAFEGFRLCKMAPTKDR
SCHEMBL16332766 0.90 PIK3CA (0.44) BRAFEGFRACVR1MAPTMEN1
SCHEMBL16331795 0.89 BRAF (0.43) BRAFEGFRERBB2ACVR1LCK
SCHEMBL16331745 0.87 BRAF (0.42) BRAFEGFRACVR1LCKKDR
SCHEMBL16331998 0.86 PTK2 (0.55) BRAFACVR1PTK2
SCHEMBL16331561 0.85 BRAF (0.56) BRAFEGFRERBB2PTK2
SCHEMBL16331719 0.85 EGFR (0.42) BRAFEGFRERBB2ACVR1KDR
SCHEMBL16332689 0.84 MEN1 (0.51) BRAFEGFRACVR1LCKKDR
SCHEMBL16331298 0.84 PIK3CA (0.44) BRAFEGFRMAPTMEN1KMT2A
SCHEMBL16331973 0.83 BRAF (0.51) BRAFEGFRACVR1LCKKDR

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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