SCHEMBL18633111

SCHEMBL18633111

CN1CC2CCC(C1)C2CCOc1cc2ncnc(Nc3ccc(F)c(CI)c3)c2cc1[N+](=O)[O-]

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.57
▸ FBP1 P09467 1/20 0.47

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
SCHEMBL15090624 0.90 EGFR (0.69) EGFR
SCHEMBL18633113 0.87 EGFR (0.58) EGFRFBP1
SCHEMBL18633151 0.84 EGFR (0.58) EGFRFBP1
SCHEMBL15112807 0.82 EGFR (0.69) EGFRFBP1
SCHEMBL15112826 0.82 EGFR (0.69) EGFRFBP1
SCHEMBL18633108 0.82 EGFR (0.69) EGFRFBP1
SCHEMBL18862789 0.81 EGFR (0.63) EGFRFBP1
SCHEMBL18633146 0.78 EGFR (0.46) EGFRFBP1
SCHEMBL18632980 0.77 EGFR (0.48) EGFRFBP1
SCHEMBL15090649 0.77 EPHA2 (0.55) EGFRFBP1

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
EP-2612860-B1 QUINAZOLINE DERIVATIVES SUBSTITUTED BY ANILINE, PREPARATION METHOD AND USE THEREOF XUANZHU PHARMA CO LTD (CN) 2017-03-15 — — EP disclosed
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