SCHEMBL26005290

SCHEMBL26005290

Cc1cc(Nc2ncnc3ccc(N4CCN(C(=O)OC(C)(C)C)[C@H](C)C4)c(F)c23)ccc1Oc1ccn2ncnc2c1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 13/20 0.52
EGFR P00533 8/20 0.52

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
SCHEMBL30575910 1.00 ERBB2 (0.52) ERBB2EGFR
SCHEMBL25431089 0.92 ERBB2 (0.55) ERBB2EGFR
SCHEMBL25431081 0.92 ERBB2 (0.55) ERBB2EGFR
SCHEMBL29935838 0.90 EGFR (0.56) ERBB2EGFR
SCHEMBL26005263 0.90 EGFR (0.56) ERBB2EGFR
SCHEMBL25429663 0.89 EGFR (0.55) ERBB2EGFR
SCHEMBL25429668 0.89 EGFR (0.55) ERBB2EGFR
SCHEMBL31541191 0.88 ERBB2 (0.52) ERBB2EGFR
SCHEMBL30576108 0.88 ERBB2 (0.52) ERBB2EGFR
SCHEMBL26008871 0.88 ERBB2 (0.52) ERBB2EGFR

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-2023154124-A1 ACYLATED HETEROCYCLIC QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed