SCHEMBL18633151

SCHEMBL18633151

CN1CCC2(CC1)CC(CCOc1cc3ncnc(Nc4ccc(F)c(CI)c4)c3cc1[N+](=O)[O-])C2

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.58
▸ FGFR1 P11362 2/20 0.43
▸ FLT1 P17948 2/20 0.43
▸ FLT4 P35916 2/20 0.43
▸ KDR P35968 2/20 0.43
▸ FBP1 P09467 1/20 0.43

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
SCHEMBL15090813 0.90 EGFR (0.71) EGFR
SCHEMBL18633111 0.84 EGFR (0.57) EGFRFBP1
SCHEMBL18633146 0.83 EGFR (0.46) EGFRKDRFBP1
SCHEMBL15090622 0.83 EGFR (0.70) EGFRKDRFBP1
SCHEMBL18633147 0.80 EGFR (0.59) EGFRFGFR1FLT1FLT4KDR
SCHEMBL15090653 0.80 EGFR (0.71) EGFR
SCHEMBL18862789 0.79 EGFR (0.63) EGFRFLT4KDRFBP1
SCHEMBL15100019 0.78 EGFR (0.73) EGFR
SCHEMBL15100099 0.77 EGFR (0.58) EGFRFLT1KDRFBP1
SCHEMBL14387983 0.77 EGFR (0.48) EGFRKDR

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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