SCHEMBL24714001

SCHEMBL24714001

COc1cc2ncnc(Nc3cc(-c4ccc(F)cc4F)ccc3OC)c2cc1O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.63
RAF1 P04049 10/20 0.63
KDR P35968 8/20 0.62
FLT1 P17948 3/20 0.62
FGFR1 P11362 2/20 0.62
EGFR P00533 1/20 0.59
RET P07949 6/20 0.55
KIF5B P33176 6/20 0.55

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
SCHEMBL8684 0.86 KDR (0.82) BRAFRAF1KDRFLT1FGFR1
SCHEMBL24714969 0.83 EGFR (0.63) KDRFLT1FGFR1EGFR
SCHEMBL24714698 0.83 KDR (0.53) BRAFRAF1KDRFLT1FGFR1
SCHEMBL24714059 0.82 KDR (0.56) BRAFRAF1KDRFLT1FGFR1
SCHEMBL27139767 0.80 EGFR (0.52) KDRFLT1FGFR1EGFR
SCHEMBL27138558 0.80 EGFR (0.49) BRAFRAF1KDRFLT1FGFR1
SCHEMBL24714966 0.80 KDR (0.49) BRAFRAF1KDRFLT1FGFR1
SCHEMBL27151754 0.79 KDR (0.55) BRAFRAF1KDRFLT1FGFR1
SCHEMBL14964757 0.78 EGFR (0.81) BRAFRAF1KDRFLT1EGFR
SCHEMBL15051770 0.78 RAF1 (1.00) BRAFRAF1KDRFLT1FGFR1

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