SCHEMBL10995336

SCHEMBL10995336

CC(=O)Oc1ccccc1C1SC[C@@H](C(=O)O)N1C(=O)[C@@H](CS)C(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 15/20 0.43
▸ ACE P12821 2/20 0.42
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.38

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
SCHEMBL10999348 0.88 ACE (0.47) FFAR2ACELMNAHTT
SCHEMBL10995341 0.84 ACE (0.44) FFAR2ACELMNAHTT
SCHEMBL11110323 0.80 FFAR2 (0.47) FFAR2ACELMNAHTT
SCHEMBL10938811 0.79 ACE (0.63) FFAR2ACELMNAHTT
SCHEMBL11066109 0.79 ACE (0.63) FFAR2ACELMNAHTT
SCHEMBL10995338 0.78 ACE (0.47) FFAR2ACELMNA
SCHEMBL11061433 0.77 HSD17B10 (0.49) FFAR2ACELMNA
SCHEMBL10999357 0.75 ACE (0.49) FFAR2ACELMNAHTT
SCHEMBL10968292 0.74 ACE (0.64) FFAR2ACELMNAHTT
SCHEMBL11075090 0.73 FFAR2 (0.52) FFAR2ACEHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4496578-A Antihypertensive sulfur-containing compounds SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-01-29 — — US disclosed
US-4483861-A Antihypertensive sulfur-containing compounds SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-11-20 — — US disclosed
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