SCHEMBL6060759

SCHEMBL6060759

CCOc1cc2c(Nc3ccc(Cl)cc3F)ncnc2cc1OCC1CCN(C)CC1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.86
KDR P35968 14/20 0.86
FGFR1 P11362 13/20 0.86
FLT1 P17948 13/20 0.86
FLT4 P35916 12/20 0.86
PDGFRB P09619 2/20 0.72
TEK Q02763 2/20 0.72
RET P07949 2/20 0.72
EPHA2 P29317 2/20 0.72
EPHB4 P54760 2/20 0.72
SRC P12931 2/20 0.72
BMPR1B O00238 1/20 0.72
PLK4 O00444 1/20 0.72
CIT O14578 1/20 0.72
GAK O14976 1/20 0.72
EPHB6 O15197 1/20 0.72
RIPK2 O43353 1/20 0.72
ROCK2 O75116 1/20 0.72
STK10 O94804 1/20 0.72
MAP4K4 O95819 1/20 0.72

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
SCHEMBL2137353 0.93 EGFR (0.98) EGFRKDRFGFR1FLT1FLT4
Hydrochloric Acid SCHEMBL2140851 0.92 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL4544070 0.90 EGFR (0.87) EGFRKDRFGFR1FLT1FLT4
SCHEMBL14095970 0.87 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL1469920 0.85 KDR (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL1467082 0.85 KDR (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL1467578 0.85 KDR (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL14095983 0.85 FGFR1 (1.00) EGFRKDRFGFR1FLT1FLT4
SCHEMBL12534441 0.84 EGFR (0.85) EGFRKDRFGFR1FLT1FLT4
Vandetanib SCHEMBL9044 0.83 EGFR (1.00) EGFRKDRFGFR1FLT1FLT4

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-1658849-A2 Therapeutic combinations of antihypertensive and antiangiogenic agents AstraZeneca AB (SE) 2006-05-24 EP disclosed