SCHEMBL18633147

SCHEMBL18633147

CN1CCC2(CC1)CC(COc1cc3ncnc(Nc4ccc(F)c(CI)c4)c3cc1N)C2

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.59
▸ KDR P35968 4/20 0.46
▸ EPHA2 P29317 1/20 0.46
▸ EPHB4 P54760 1/20 0.46
▸ FGFR1 P11362 2/20 0.45
▸ FLT1 P17948 2/20 0.45
▸ FLT4 P35916 2/20 0.45
▸ RET P07949 2/20 0.44
▸ KIF5B P33176 1/20 0.44

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
SCHEMBL255527 0.89 EGFR (0.72) EGFRKDREPHA2EPHB4FLT4
SCHEMBL18633148 0.84 EGFR (0.71) EGFR
SCHEMBL18633102 0.83 EGFR (0.51) EGFRKDREPHA2EPHB4FGFR1
SCHEMBL18633014 0.82 EGFR (0.69) EGFR
SCHEMBL15100019 0.81 EGFR (0.73) EGFR
SCHEMBL18633015 0.81 EGFR (0.67) EGFRRET
SCHEMBL18633004 0.81 EGFR (0.50) EGFRKDREPHA2EPHB4FLT4
SCHEMBL18633151 0.80 EGFR (0.58) EGFRKDRFGFR1FLT1FLT4
SCHEMBL256543 0.79 EGFR (0.59) EGFRKDREPHA2EPHB4FLT4
SCHEMBL15090717 0.79 EGFR (0.73) EGFRKDREPHA2EPHB4FLT4

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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