SCHEMBL29679376

SCHEMBL29679376

CCCCC(C=CC(=O)Nc1ccc(F)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.54

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
SCHEMBL11929409 0.84 CTSK (0.50) CTSK
SCHEMBL11929410 0.80 CTSK (0.51) CTSK
SCHEMBL23483309 0.80 CTSK (0.55) CTSK
SCHEMBL5493959 0.77 CTSK (0.59) CTSK
SCHEMBL5493965 0.77 CTSK (0.59) CTSK
SCHEMBL12809459 0.77 CTSK (0.44) CTSK
SCHEMBL28792471 0.77 CTSK (0.46) CTSK
SCHEMBL10266406 0.74 CTSK (0.40) CTSK
SCHEMBL2771197 0.73 CTSK (0.56) CTSK
SCHEMBL10270524 0.73 GAA (0.48) CTSK

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
CN-114761079-A Benzothia (di) azepin compounds and their use as bile acid modulators 阿尔比里奥公司 2022-07-15 CN disclosed