SCHEMBL16331602

SCHEMBL16331602

CNc1nc2cnc(Nc3ccc(OC)c(OC)c3)cc2n1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ IGF1R P08069 1/20 0.43
▸ PLK1 P53350 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ SHMT2 P34897 1/20 0.42
▸ ABCG2 Q9UNQ0 4/20 0.40
▸ ABCB1 P08183 3/20 0.40
▸ ABCC1 P33527 2/20 0.40
▸ FLT1 P17948 1/20 0.40
▸ FLT4 P35916 1/20 0.40
▸ KDR P35968 1/20 0.40
▸ MAP3K11 Q16584 1/20 0.40

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
SCHEMBL16331454 0.90 BRAF (0.49) FLT3MEN1KMT2AIGF1RPLK1
SCHEMBL16331787 0.87 MAPK9 (0.51) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL16332695 0.87 MAPT (0.42) ALDH1A1MAPTKDM4EPLK1ABCG2
SCHEMBL16332328 0.85 MEN1 (0.51) ALDH1A1MAPTMEN1KMT2AIGF1R
SCHEMBL16332856 0.82 PDGFRB (0.50) FLT3ALDH1A1IGF1RPLK1PDGFRB
SCHEMBL16332011 0.82 MAPT (0.43) FLT3ALDH1A1MAPTMEN1KMT2A
SCHEMBL16332572 0.81 PIK3CA (0.48) MAPTMEN1KMT2APLK1ABCG2
SCHEMBL16331745 0.81 BRAF (0.42) MEN1KMT2AIGF1RKDRAURKA
SCHEMBL16331252 0.80 JAK3 (0.46) FLT3ALDH1A1MAPTMEN1KMT2A
SCHEMBL16332095 0.80 RAD52 (0.40) KMT2AFYNMAPK9MAPK8

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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