SCHEMBL8444635

SCHEMBL8444635

COc1cc2nc(N(Cl)c3ccc(F)cc3)ncc2cc1OCC1COCO1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 13/20 0.36
▸ PDGFRB P09619 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KDR P35968 9/20 0.33
▸ EPHB4 P54760 7/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ KIT P10721 1/20 0.32
▸ ERBB2 P04626 7/20 0.31
▸ FLT1 P17948 7/20 0.31
▸ FLT3 P36888 1/20 0.31

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
SCHEMBL8520906 0.84 JAK2 (0.35) EPHA2PDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL8522035 0.84 JAK2 (0.35) EPHA2PDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL8436900 0.80 EPHA2 (0.42) EPHA2PDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL8438071 0.79 KDR (0.38) EPHA2PDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL8444662 0.79 EPHA2 (0.44) EPHA2PDGFRBPDGFRAKDM4EALDH1A1
SCHEMBL6266570 0.77 EGFR (0.46) EPHA2KDREPHB4FLT1
SCHEMBL28962458 0.76 EPHA2 (0.45) EPHA2KDREPHB4KIT
SCHEMBL6269488 0.76 EGFR (0.42) PDGFRBPDGFRAKDM4EALDH1A1SMN1; SMN2
SCHEMBL3727488 0.76 EGFR (0.49) KDREPHB4IRAK4KITERBB2
SCHEMBL5618725 0.75 EHMT2 (0.51) EPHA2KDREPHB4FLT1

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-0892799-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1999-01-27 — — EP claimed
WO-1997038994-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-10-23 — — WO claimed
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