SCHEMBL24713892

SCHEMBL24713892

CCC(CC)Oc1cc2c(Nc3cc(-c4ccc(F)c(C(F)F)c4)ccc3OC)ncnc2cc1OC

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.54
FLT1 P17948 6/20 0.54
FGFR1 P11362 4/20 0.54
RET P07949 9/20 0.52
KIF5B P33176 8/20 0.52
FLT4 P35916 3/20 0.52
EPHB2 P29323 1/20 0.52
EGFR P00533 9/20 0.52
AURKA O14965 1/20 0.48
ERBB2 P04626 1/20 0.48
INSR P06213 1/20 0.48
FBP1 P09467 1/20 0.48
PDGFRB P09619 1/20 0.48
CLK1 P49759 1/20 0.48
EPHB4 P54760 1/20 0.48
TEK Q02763 1/20 0.48
AURKB Q96GD4 1/20 0.48
RIPK2 O43353 1/20 0.48
NOD1 Q9Y239 1/20 0.48

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
SCHEMBL24715171 0.86 EGFR (0.61) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714553 0.83 KDR (0.51) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714059 0.83 KDR (0.56) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714932 0.82 KDR (0.52) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714671 0.81 KDR (0.49) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714946 0.81 EGFR (0.49) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714641 0.80 EGFR (0.56) KDRFLT1FGFR1RETKIF5B
SCHEMBL24713989 0.79 EGFR (0.55) KDRFLT1RETKIF5BEPHB2
SCHEMBL24714457 0.79 KDR (0.51) KDRFLT1FGFR1RETKIF5B
SCHEMBL24714943 0.78 EGFR (0.56) KDRFLT1FGFR1RETKIF5B

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
WO-2022225238-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 보로노이 주식회사 2022-10-27 WO disclosed