SCHEMBL24037409

SCHEMBL24037409

COc1cc2ncnc(Nc3ccc(Oc4cccc(-c5nnc(C)o5)c4)cc3F)c2cc1NC1CNC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.48
KDR P35968 10/20 0.43
FLT1 P17948 9/20 0.43
FGFR1 P11362 7/20 0.43
FLT4 P35916 5/20 0.43
RET P07949 1/20 0.43
KIF5B P33176 1/20 0.43
EPHA2 P29317 6/20 0.42
EPHB2 P29323 1/20 0.42
ERBB4 Q15303 1/20 0.42
EPHB4 P54760 3/20 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
SCHEMBL24037412 0.86 EGFR (0.57) EGFR
SCHEMBL21616332 0.86 EGFR (0.48) EGFRKDRFLT1FGFR1FLT4
SCHEMBL24037410 0.86 KDR (0.52) EGFRKDRFLT1FGFR1FLT4
SCHEMBL30203115 0.86 EGFR (0.48) EGFRKDRFLT1FGFR1FLT4
SCHEMBL24037411 0.85 EGFR (0.44) EGFREPHA2ERBB4EPHB4
SCHEMBL21616281 0.83 EGFR (0.49) EGFRKDRFLT1FGFR1FLT4
SCHEMBL23355315 0.82 EGFR (0.48) EGFRKDRFLT1FGFR1FLT4
SCHEMBL21616265 0.81 EGFR (0.47) EGFRKDRFLT1FGFR1FLT4
SCHEMBL24037712 0.81 EGFR (0.61) EGFR
SCHEMBL21612780 0.81 EGFR (0.61) EGFRRETEPHB2EPHB4

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-2021231400-A1 BIS-ARYL ETHERS CONTAINING N-ACYL AZETIDINE AS EGFR/HER2 INHIBITORS ACCUTAR BIOTECHNOLOGY, INC. (US) 2021-11-18 WO disclosed