SCHEMBL8414368

SCHEMBL8414368

CC(CSCc1ccccc1)C(=O)NC(CC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACE P12821 15/20 0.61
PPARG P37231 3/20 0.57
PPARA Q07869 3/20 0.57
PPARD Q03181 2/20 0.53

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
SCHEMBL8414370 1.00 ACE (0.61) ACEPPARGPPARAPPARD
SCHEMBL8414708 0.89 ACE (0.51) ACEPPARGPPARAPPARD
SCHEMBL8414944 0.81 HDAC3 (0.39) ACEPPARGPPARA
SCHEMBL8410793 0.79 CASP1 (0.55) ACEPPARGPPARA
SCHEMBL29498364 0.78 ACE (0.48) ACE
SCHEMBL5853138 0.77 PPARA (0.90) ACEPPARGPPARAPPARD
SCHEMBL3362562 0.77 PPARA (0.90) ACEPPARGPPARAPPARD
SCHEMBL3582418 0.77 PPARA (0.90) ACEPPARGPPARAPPARD
SCHEMBL18342569 0.76 CTSK (0.55) PPARA
SCHEMBL20263594 0.76 CTSK (0.55) PPARA

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-0932598-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-08-04 EP disclosed
WO-1998016502-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1998-04-23 WO disclosed