SCHEMBL30640294

SCHEMBL30640294

COCC1COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4F)c3cc2O1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.66
EPHA2 P29317 15/20 0.54
KDR P35968 13/20 0.54
ERBB2 P04626 12/20 0.54
EPHB4 P54760 12/20 0.54
FLT1 P17948 10/20 0.54
GAK O14976 1/20 0.54
EPHB6 O15197 1/20 0.54
RIPK2 O43353 1/20 0.54
STK10 O94804 1/20 0.54
MAP4K4 O95819 1/20 0.54
ABL1 P00519 1/20 0.54
LCK P06239 1/20 0.54
YES1 P07947 1/20 0.54
LYN P07948 1/20 0.54
RET P07949 1/20 0.54
HCK P08631 1/20 0.54
BCR P11274 1/20 0.54
SRC P12931 1/20 0.54
EPHA1 P21709 1/20 0.54

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
SCHEMBL30640277 0.88 EGFR (0.70) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6800284 0.86 EGFR (0.55) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6795098 0.84 EGFR (0.58) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6794421 0.84 EGFR (0.63) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6789452 0.82 EGFR (0.50) EGFREPHA2ERBB2EPHB4
SCHEMBL30640367 0.82 EGFR (0.56) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6794957 0.82 EGFR (0.57) EGFREPHA2KDRERBB2EPHB4
SCHEMBL6793039 0.81 EGFR (0.61) EGFREPHA2KDRERBB2FLT1
SCHEMBL30640332 0.81 EGFR (0.59) EGFRKDRERBB2EPHB4RIPK2
SCHEMBL20865233 0.80 EGFR (1.00) EGFREPHA2KDRERBB2EPHB4

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-112079830-B Inhibitor containing fused ring derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-22 CN disclosed