SCHEMBL16331973

SCHEMBL16331973

CNc1nc2cnc(Nc3ccc(O)cc3)cc2n1-c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 7/20 0.51
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PIK3CA P42336 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ PRKDC P78527 1/20 0.40
▸ EGFR P00533 4/20 0.39
▸ ACVR1 Q04771 1/20 0.39
▸ MAP3K11 Q16584 1/20 0.38
▸ KDR P35968 3/20 0.38
▸ LCK P06239 2/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ MAP2K1 Q02750 1/20 0.37
▸ IGF1R P08069 1/20 0.37
▸ GAK O14976 1/20 0.36
▸ RIPK2 O43353 1/20 0.36
▸ STK10 O94804 1/20 0.36
▸ RET P07949 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ JAK3 P52333 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
SCHEMBL16332689 0.91 MEN1 (0.51) BRAFMEN1KMT2APIK3CAMTOR
SCHEMBL16331745 0.90 BRAF (0.42) BRAFMEN1KMT2AEGFRACVR1
SCHEMBL16331795 0.89 BRAF (0.43) BRAFPIK3CAMTORPRKDCEGFR
SCHEMBL16331533 0.89 BRAF (0.54) BRAFMEN1KMT2APIK3CAMTOR
SCHEMBL16332023 0.87 SMN1; SMN2 (0.42) BRAFMEN1KMT2AEGFRACVR1
SCHEMBL16331388 0.85 BRD4 (0.51) EGFRKDRFLT3
SCHEMBL16332766 0.84 PIK3CA (0.44) BRAFMEN1KMT2APIK3CAPRKDC
SCHEMBL16331719 0.84 EGFR (0.42) BRAFEGFRACVR1KDRIGF1R
SCHEMBL16331454 0.84 BRAF (0.49) BRAFMEN1KMT2AEGFRMAP3K11
SCHEMBL16332000 0.83 BRAF (0.53) BRAFMEN1KMT2AEGFRACVR1

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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