SCHEMBL31598719

SCHEMBL31598719

COCCOc1cc2nccc(Nc3cccc(C(C)=O)c3)c2cc1OCCOC

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 11/20 0.67
▸ GAK O14976 3/20 0.67
▸ KDR P35968 4/20 0.50
▸ FGFR1 P11362 3/20 0.50
▸ FLT1 P17948 3/20 0.50
▸ ERBB2 P04626 1/20 0.49
▸ DNMT1 P26358 1/20 0.48
▸ DNMT3A Q9Y6K1 1/20 0.48
▸ PDGFRA P16234 1/20 0.47
▸ FBP1 P09467 1/20 0.46

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
SCHEMBL7001923 0.83 EGFR (0.77) EGFRGAKKDRFGFR1FLT1
SCHEMBL27865264 0.80 FGFR1 (0.70) EGFRGAKKDRFGFR1FLT1
SCHEMBL13824816 0.80 EGFR (1.00) EGFRGAKKDRFGFR1FLT1
SCHEMBL29749690 0.80 EGFR (1.00) EGFRGAKKDRFGFR1FLT1
Hydrochloric Acid SCHEMBL29785616 0.79 EGFR (0.98) EGFRGAKKDRFGFR1FLT1
Hydrochloric Acid SCHEMBL6786236 0.76 EGFR (0.66) EGFRGAKKDRERBB2PDGFRA
SCHEMBL4751350 0.76 CYP2D6 (0.58) GAKERBB2DNMT1DNMT3A
SCHEMBL28415090 0.75 EGFR (0.74) EGFRGAKKDRFGFR1FLT1
SCHEMBL6431478 0.75 FGFR1 (0.62) EGFRGAKKDRFGFR1FLT1
Hydrochloric Acid SCHEMBL6430782 0.74 FGFR1 (0.61) EGFRGAKKDRFGFR1FLT1

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
CN-120058675-A Preparation and purification method and application of quinoline derivative with biological activity 河南科技大学 2025-05-30 — — CN disclosed
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