SCHEMBL18688394

SCHEMBL18688394

COc1cc2nccc(Oc3cccc(NCCCBr)c3)c2cc1OC

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.61
▸ PDGFRA P16234 2/20 0.58
▸ FGFR2 P21802 1/20 0.56
▸ KDR P35968 2/20 0.55
▸ PDGFRB P09619 2/20 0.55
▸ CSF1R P07333 1/20 0.54
▸ FLT4 P35916 1/20 0.54
▸ FLT3 P36888 1/20 0.54

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
SCHEMBL5825268 0.84 PDGFRA (0.66) PDGFRAFGFR2KDRPDGFRBCSF1R
SCHEMBL18688436 0.82 EGFR (0.69) EGFRPDGFRAFGFR2KDRPDGFRB
SCHEMBL7481076 0.80 EGFR (0.78) EGFRPDGFRAFGFR2PDGFRB
SCHEMBL5825225 0.79 FGFR2 (0.69) PDGFRAFGFR2KDR
SCHEMBL5826066 0.77 PDGFRA (0.66) PDGFRAFGFR2KDRPDGFRB
SCHEMBL31060617 0.77 EGFR (1.00) EGFRPDGFRAFGFR2KDRPDGFRB
SCHEMBL7490337 0.77 EGFR (0.72) EGFRPDGFRAFGFR2KDRPDGFRB
SCHEMBL31060866 0.77 EGFR (0.72) EGFRPDGFRAFGFR2KDRPDGFRB
SCHEMBL5824771 0.77 FGFR2 (0.62) PDGFRAFGFR2KDRPDGFRB
SCHEMBL5825549 0.76 FGFR2 (0.62) PDGFRAFGFR2KDRPDGFRB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017049462-A1 NOVEL FLT3 KINASE INHIBITOR AND USES THEREOF 合肥中科普瑞昇生物医药科技有限公司 2017-03-30 — — WO disclosed
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