SCHEMBL7802802

SCHEMBL7802802

CN(C)c1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1F

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 18/20 0.66
▸ FBP1 P09467 2/20 0.66
▸ AURKA O14965 1/20 0.66
▸ ERBB2 P04626 1/20 0.66
▸ INSR P06213 1/20 0.66
▸ PDGFRB P09619 1/20 0.66
▸ FLT4 P35916 1/20 0.66
▸ KDR P35968 1/20 0.66
▸ CLK1 P49759 1/20 0.66
▸ EPHB4 P54760 1/20 0.66
▸ TEK Q02763 1/20 0.66
▸ AURKB Q96GD4 1/20 0.66
▸ GRM1 Q13255 1/20 0.61

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
SCHEMBL28403915 0.86 EGFR (0.74) EGFRFBP1AURKAERBB2INSR
SCHEMBL12788058 0.83 EGFR (0.72) EGFRFBP1AURKAERBB2INSR
SCHEMBL7802281 0.82 EGFR (0.67) EGFRFBP1AURKAERBB2INSR
SCHEMBL2991661 0.81 EGFR (0.75) EGFRFBP1AURKAERBB2INSR
SCHEMBL7814811 0.81 EGFR (0.89) EGFRFBP1AURKAERBB2INSR
SCHEMBL7811745 0.81 EGFR (0.64) EGFRERBB2
SCHEMBL5843772 0.80 EGFR (0.69) EGFRFBP1AURKAERBB2INSR
SCHEMBL8311292 0.80 EGFR (0.77) EGFRFBP1AURKAERBB2INSR
Hydrochloric Acid SCHEMBL7811119 0.80 EGFR (0.87) EGFRFBP1AURKAERBB2INSR
SCHEMBL8310628 0.80 EGFR (0.67) EGFRFBP1AURKAERBB2INSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635498-B1 Quinazoline derivatives and their use as anti-cancer agents SYNGENTA LTD (GB) 2001-04-18 — — EP disclosed
US-5475001-A Quinazoline derivatives ZENECA LIMITED (GB) 1995-12-12 — — US disclosed
WO-1995003283-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS ZENECA LIMITED (GB) 1995-02-02 — — WO disclosed
EP-0635498-A1 Quinazoline derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 — — EP disclosed
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