SCHEMBL10946334

SCHEMBL10946334

O=C(O)CCCC(=O)N1C(c2cccc(O)c2)SC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.49
▸ HSD17B10 Q99714 1/20 0.43
▸ KIF11 P52732 2/20 0.41
▸ FFAR2 O15552 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ MME P08473 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL11059109 0.87 ACE (0.65) ACEHSD17B10KIF11FFAR2GAA
SCHEMBL10943470 0.82 ACE (0.43) ACEHSD17B10FFAR2GAAPOLB
SCHEMBL10942483 0.82 ACE (0.43) ACEHSD17B10FFAR2GAAPOLB
SCHEMBL10942993 0.81 L3MBTL1 (0.44) ACEPOLB
SCHEMBL10944246 0.81 L3MBTL1 (0.44) ACEPOLB
SCHEMBL10939993 0.80 ACE (0.57) ACEHSD17B10FFAR2GAAPOLB
SCHEMBL10945382 0.80 ACE (0.41) ACEHSD17B10FFAR2GAAPOLB
SCHEMBL10941190 0.80 ACE (0.41) ACEHSD17B10FFAR2GAAPOLB
SCHEMBL11385315 0.80 ACE (0.43) ACEHSD17B10KIF11FFAR2GAA
SCHEMBL10945754 0.80 TBXAS1 (0.47) ACEHSD17B10KDM4E

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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