SCHEMBL25938865

SCHEMBL25938865

Cc1cc2[nH]c(Cn3cccc(NC(=O)CCC/C=C/C(=O)N(C)C)c3=O)nc2c(CC(C)C)n1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 20/20 0.58

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
SCHEMBL25938606 0.89 MAP4K1 (0.58) MAP4K1
SCHEMBL21703156 0.89 MAP4K1 (0.55) MAP4K1
SCHEMBL24859798 0.88 MAP4K1 (0.61) MAP4K1
SCHEMBL21685238 0.87 MAP4K1 (0.71) MAP4K1
SCHEMBL21685234 0.87 MAP4K1 (0.71) MAP4K1
SCHEMBL21685231 0.87 MAP4K1 (0.71) MAP4K1
SCHEMBL21703442 0.87 MAP4K1 (0.72) MAP4K1
SCHEMBL25938494 0.86 MAP4K1 (0.61) MAP4K1
SCHEMBL25938868 0.86 MAP4K1 (0.59) MAP4K1
SCHEMBL28593559 0.86 MAP4K1 (0.80) MAP4K1

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
EP-4219460-A1 TRANSGLUTAMINASE 2 (TG2) INHIBITORS Sitari Pharma, Inc. (US) 2023-08-02 EP disclosed