SCHEMBL10945754

SCHEMBL10945754

O=C(O)CCCCCCCC(=O)N1C(c2cccnc2)SC[C@H]1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 11/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ ACE P12821 2/20 0.45
▸ HSD17B10 Q99714 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
SCHEMBL9853999 0.80 POLB (0.58) KDM4EALDH1A1HSD17B10
SCHEMBL10943470 0.80 ACE (0.43) ACEHSD17B10
SCHEMBL10942483 0.80 ACE (0.43) ACEHSD17B10
SCHEMBL10946334 0.80 ACE (0.49) KDM4EACEHSD17B10
SCHEMBL10945275 0.80 FFAR2 (0.48) ALDH1A1ACEHSD17B10
SCHEMBL10940821 0.80 GAA (0.46) ALDH1A1ACEHSD17B10
Acetic Acid SCHEMBL9854087 0.79 POLB (0.57) KDM4EALDH1A1HSD17B10
SCHEMBL10944246 0.79 L3MBTL1 (0.44) ALDH1A1ACE
SCHEMBL10942993 0.79 L3MBTL1 (0.44) ALDH1A1ACE
SCHEMBL10939993 0.79 ACE (0.57) ALDH1A1ACEHSD17B10

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
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