SCHEMBL24714014

SCHEMBL24714014

COc1cc2ncnc(Nc3cc(-c4ccco4)ccc3OC)c2cc1O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RET P07949 9/20 0.55
EGFR P00533 3/20 0.54
KIF5B P33176 6/20 0.53
KDR P35968 5/20 0.53
BRAF P15056 8/20 0.53
RAF1 P04049 7/20 0.53

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
SCHEMBL29168733 0.88 EGFR (0.54) RETEGFRKIF5BKDR
SCHEMBL30820451 0.88 EGFR (0.54) RETEGFRKIF5BKDR
SCHEMBL27151646 0.84 EGFR (0.54) RETEGFRKDR
SCHEMBL30820598 0.84 ABCG2 (0.59) RETEGFRKIF5BKDRBRAF
SCHEMBL24714641 0.83 EGFR (0.56) RETEGFRKIF5BKDR
SCHEMBL24713876 0.83 EGFR (0.56) RETEGFRKIF5BKDR
SCHEMBL30822096 0.82 EGFR (0.57) EGFRKDR
SCHEMBL27140470 0.82 EGFR (0.57) EGFRKDR
SCHEMBL24713875 0.82 EGFR (0.55) RETEGFRKIF5BKDR
SCHEMBL24714079 0.82 EGFR (0.47) RETEGFRKIF5BKDR

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