SCHEMBL6575413

SCHEMBL6575413

CN(C)c1ccc(CSC[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.73
PPARG P37231 11/20 0.73
PPARD Q03181 2/20 0.70
ACE P12821 4/20 0.64

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
SCHEMBL6574106 1.00 PPARA (0.73) PPARAPPARGPPARDACE
SCHEMBL8450418 0.91 PPARA (0.70) PPARAPPARGPPARDACE
SCHEMBL6575983 0.90 PPARG (0.69) PPARAPPARGPPARDACE
SCHEMBL6576323 0.90 PPARA (0.59) PPARAPPARGPPARDACE
SCHEMBL6574323 0.90 PPARA (0.69) PPARAPPARGPPARDACE
SCHEMBL6576396 0.88 PPARA (0.70) PPARAPPARGPPARDACE
SCHEMBL6578263 0.88 PPARA (0.60) PPARAPPARGPPARDACE
SCHEMBL6574034 0.87 PPARA (0.56) PPARAPPARGPPARDACE
SCHEMBL7331137 0.86 PPARA (0.89) PPARAPPARGPPARDACE
SCHEMBL4422552 0.86 PPARA (0.89) PPARAPPARGPPARDACE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0870762-B1 NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2004-04-28 EP disclosed
US-5872281-A COMPOUNDS FOR TREATMENT OF RHEUMATIC DISEASES, PSORIASIS, INTESTINAL INFLAMATION SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-02-16 US disclosed
EP-0870762-A1 NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed