SCHEMBL8202192

SCHEMBL8202192

COC(=O)Oc1cc(Nc2ncnc3cc(OCc4ccc(C)nc4Cl)c(OC)cc23)c(F)cc1C

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.54
FLT1 P17948 10/20 0.54
RET P07949 7/20 0.54
KIF5B P33176 7/20 0.54
FGFR1 P11362 6/20 0.54
EGFR P00533 6/20 0.52
FLT4 P35916 4/20 0.50
EPHB2 P29323 1/20 0.50
MAPK14 Q16539 2/20 0.49
FGFR2 P21802 1/20 0.49
FGFR4 P22455 1/20 0.49
FGFR3 P22607 1/20 0.49

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
SCHEMBL7455756 0.85 KDR (0.54) KDRFLT1RETKIF5BFGFR1
SCHEMBL7211052 0.84 EGFR (0.59) KDRFLT1RETKIF5BFGFR1
Hydrochloric Acid SCHEMBL7454404 0.83 EGFR (0.58) KDRFLT1RETKIF5BFGFR1
SCHEMBL7454958 0.81 KDR (0.67) KDRFLT1RETKIF5BFGFR1
SCHEMBL7209561 0.80 KDR (0.67) KDRFLT1RETKIF5BFGFR1
SCHEMBL7452337 0.79 KDR (0.56) KDRFLT1RETKIF5BFGFR1
Hydrochloric Acid SCHEMBL7448336 0.79 KDR (0.66) KDRFLT1RETKIF5BFGFR1
Hydrochloric Acid SCHEMBL7214453 0.78 KDR (0.59) KDRFLT1RETKIF5BFGFR1
SCHEMBL7209629 0.76 KDR (0.79) KDRFLT1RETKIF5BFGFR1
Hydrochloric Acid SCHEMBL7209962 0.76 KDR (0.54) KDRFLT1RETKIF5BFGFR1

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
US-6071921-A Chemical compounds ZENECA LIMITED (GB) 2000-06-06 US disclosed