SCHEMBL10940950

SCHEMBL10940950

COC(=O)CC(C)C(=O)N1C(c2ccccc2O)SC[C@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.56
FFAR2 O15552 9/20 0.43
HTT P42858 1/20 0.43
POLB P06746 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL10940835 0.89 ACE (0.60) ACEFFAR2HTTPOLBALDH1A1
SCHEMBL11065988 0.85 ACE (0.67) ACELMNA
SCHEMBL683556 0.85 ACE (0.67) ACELMNA
SCHEMBL11194036 0.84 ACE (0.59) ACEFFAR2HTTPOLBALDH1A1
SCHEMBL683644 0.83 ACE (0.67) ACEFFAR2HTTPOLBALDH1A1
SCHEMBL11062257 0.80 ACE (0.55) ACEFFAR2HTTLMNA
SCHEMBL683927 0.80 ACE (0.52) ACEPOLBALDH1A1
SCHEMBL10968292 0.77 ACE (0.64) ACEFFAR2HTTPOLBALDH1A1
SCHEMBL11075090 0.76 FFAR2 (0.52) ACEFFAR2HTT
SCHEMBL11062261 0.75 ACE (0.56) ACEFFAR2HTTPOLBALDH1A1

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-0031104-B1 THIAZOLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-10-23 EP disclosed
US-4499102-A HYPOTENSIVE AND ANTIDIABETIC AGENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-02-12 US disclosed
EP-0031104-A1 Thiazolidine compounds, processes for their preparation and pharmaceutical compositions containing them SANTEN PHARMACEUTICAL CO., LTD. (JP) 1981-07-01 EP disclosed