SCHEMBL11066109

SCHEMBL11066109

O=C(c1ccccc1)[C@H](CS)C(=O)N1C(c2ccccc2O)SC[C@H]1C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.63
▸ LMNA P02545 1/20 0.44
▸ FFAR2 O15552 12/20 0.44
▸ HTT P42858 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL10938811 1.00 ACE (0.63) ACELMNAFFAR2HTTALDH1A1
SCHEMBL10941478 0.90 ACE (0.51) ACELMNAFFAR2HTTALDH1A1
SCHEMBL10968292 0.88 ACE (0.64) ACELMNAFFAR2HTTALDH1A1
SCHEMBL11061433 0.87 HSD17B10 (0.49) ACELMNAFFAR2ALDH1A1POLB
SCHEMBL11096470 0.85 ACE (0.61) ACELMNAFFAR2HTTALDH1A1
SCHEMBL10939315 0.85 ACE (0.49) ACELMNAFFAR2HPGDHSD17B10
SCHEMBL11110323 0.85 FFAR2 (0.47) ACELMNAFFAR2HTT
SCHEMBL10939281 0.84 ACE (0.49) ACELMNAFFAR2HTTALDH1A1
SCHEMBL683556 0.84 ACE (0.67) ACELMNA
SCHEMBL11065988 0.84 ACE (0.67) ACELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4430344-A Antihypertensive 4-thiazolidinecarboxylic acids SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-02-07 — — US claimed
US-4457935-A ANGIOTENSIN-CONVERTING ENZYME INHIBITOR SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-07-03 — — US disclosed
US-4430344-A Antihypertensive 4-thiazolidinecarboxylic acids SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-02-07 — — US disclosed
US-4423054-A Antihypertensive 4-thiazolidinecarboxylic acids (substituted alkyl derivatives) SANTEN PHARMACEUTICAL CO., LTD. (JP) 1983-12-27 — — US disclosed
US-4386096-A ANGIOTENSIN-CONVERTING ENZYME INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1983-05-31 — — US disclosed
US-4356183-A ENZYME INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-10-26 — — US disclosed
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