SCHEMBL5711275

SCHEMBL5711275

CC(CN)[C@H](C(=O)OC(C)(C)C)C(=O)N1CSC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)c1nc2ccccc2o1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRSS8 Q16651 2/20 0.45
CTSS P25774 18/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL5711269 0.86 CMA1 (0.49) CTSS
SCHEMBL5711191 0.85 PRSS1 (0.44)
SCHEMBL5711290 0.81 PRSS8 (0.49) PRSS8CTSSCYP3A4CYP2C9
SCHEMBL7661082 0.73 CMA1 (0.44) CTSS
SCHEMBL5711400 0.72 CAPN1 (0.39) CYP3A4
SCHEMBL5711349 0.72 CMA1 (0.50)
SCHEMBL7668464 0.72 CMA1 (0.44)
SCHEMBL5711189 0.71 CMA1 (0.49)
SCHEMBL5711368 0.69 CMA1 (0.51)
SCHEMBL5711366 0.69 CMA1 (0.58)

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-1103560-B1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-12-27 EP disclosed