SCHEMBL25938992

SCHEMBL25938992

CC(C)Cc1c(F)cc(F)c2c1nc(Cn1cccc(NC(=O)CCC/C=C/C=O)c1=O)n2C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 20/20 0.49

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
SCHEMBL21703075 0.83 MAP4K1 (0.48) MAP4K1
SCHEMBL25948610 0.81 MAP4K1 (0.65) MAP4K1
SCHEMBL25941119 0.81 MAP4K1 (0.58) MAP4K1
SCHEMBL25945676 0.81 MAP4K1 (0.62) MAP4K1
SCHEMBL21685392 0.80 MAP4K1 (0.45) MAP4K1
SCHEMBL25938464 0.80 MAP4K1 (0.63) MAP4K1
SCHEMBL25944736 0.79 MAP4K1 (0.62) MAP4K1
SCHEMBL25939341 0.79 MAP4K1 (0.58) MAP4K1
SCHEMBL21703268 0.78 MAP4K1 (0.76) MAP4K1
SCHEMBL21684099 0.77 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