SCHEMBL24713876

SCHEMBL24713876

CCC(C)c1cc2c(Nc3cc(-c4ccco4)ccc3OC)ncnc2cc1OC

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.56
MAPK1 P28482 1/20 0.46
RET P07949 6/20 0.43
KDR P35968 4/20 0.43
FLT1 P17948 1/20 0.43
KIF5B P33176 2/20 0.42
CLK4 Q9HAZ1 1/20 0.42
CLK1 P49759 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL24714053 0.95 EGFR (0.55) EGFRMAPK1RETKDRFLT1
SCHEMBL24713931 0.92 EGFR (0.52) EGFRMAPK1RETKDRFLT1
SCHEMBL24714641 0.85 EGFR (0.56) EGFRMAPK1RETKDRFLT1
SCHEMBL24714943 0.84 EGFR (0.56) EGFRMAPK1RETKDRFLT1
SCHEMBL24714929 0.83 EGFR (0.54) EGFRMAPK1RETKDRFLT1
SCHEMBL24713875 0.83 EGFR (0.55) EGFRMAPK1RETKDRFLT1
SCHEMBL30820451 0.83 EGFR (0.54) EGFRMAPK1RETKDRFLT1
SCHEMBL29168733 0.83 EGFR (0.54) EGFRMAPK1RETKDRFLT1
SCHEMBL24714014 0.83 RET (0.55) EGFRRETKDRKIF5B
SCHEMBL24714715 0.81 EGFR (0.53) EGFRMAPK1RETKDRFLT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4328222-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF Voronoi Inc. (KR) 2024-02-28 EP disclosed
WO-2022225238-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 보로노이 주식회사 2022-10-27 WO disclosed