SCHEMBL29888013

SCHEMBL29888013

Cc1cc(Nc2ncnc3ccc(Cl)nc23)ccc1Oc1ccc2c(c1)ncn2C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 13/20 0.47
EGFR P00533 4/20 0.47
MKNK2 Q9HBH9 6/20 0.44
ERBB3 P21860 1/20 0.38
ERBB4 Q15303 1/20 0.38

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
SCHEMBL24569523 1.00 ERBB2 (0.47) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL29888038 0.84 EGFR (0.56) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL24569414 0.84 EGFR (0.56) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL29888184 0.81 ERBB2 (0.46) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL24569467 0.81 ERBB2 (0.46) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL29887923 0.81 ERBB2 (0.51) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL31476048 0.81 ERBB2 (0.45) ERBB2EGFRMKNK2ERBB3ERBB4
SCHEMBL24570016 0.80 ERBB2 (0.43) ERBB2EGFR
SCHEMBL25432634 0.79 ERBB2 (0.56) ERBB2EGFR
SCHEMBL30575966 0.79 ERBB2 (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4267137-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 Enliven Inc. (US) 2023-11-01 EP disclosed
WO-2022140769-A1 LACTAM (HETERO)ARYLFUSEDPYRIMIDINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed