SCHEMBL24714932

SCHEMBL24714932

CCC(CC)Oc1cc2c(Nc3cc(-c4cc(F)cnc4F)ccc3OC)ncnc2cc1OC

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.52
FLT1 P17948 4/20 0.52
FGFR1 P11362 2/20 0.52
EGFR P00533 10/20 0.50
RET P07949 7/20 0.47
KIF5B P33176 6/20 0.47
EPHB2 P29323 1/20 0.46
FLT4 P35916 1/20 0.46
LCK P06239 1/20 0.45
CLK1 P49759 1/20 0.44
ABCG2 Q9UNQ0 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
SCHEMBL24714059 0.83 KDR (0.56) KDRFLT1FGFR1EGFRRET
SCHEMBL24713881 0.82 KDR (0.49) KDRFLT1FGFR1EGFRRET
SCHEMBL24715171 0.82 EGFR (0.61) KDRFLT1FGFR1EGFRRET
SCHEMBL24713892 0.82 KDR (0.54) KDRFLT1FGFR1EGFRRET
SCHEMBL24714666 0.82 KDR (0.46) KDRFLT1FGFR1EGFRRET
SCHEMBL24714671 0.80 KDR (0.49) KDRFLT1FGFR1EGFRRET
SCHEMBL24713941 0.79 KDR (0.49) KDRFLT1FGFR1EGFRRET
SCHEMBL24714641 0.79 EGFR (0.56) KDRFLT1FGFR1EGFRRET
SCHEMBL24714946 0.78 EGFR (0.49) KDRFLT1FGFR1EGFRRET
SCHEMBL24714457 0.78 KDR (0.51) KDRFLT1FGFR1EGFRRET

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