SCHEMBL7334064

SCHEMBL7334064

C[C@@H](COCc1ccccc1)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.57
CTSD P07339 1/20 0.49
CTSE P14091 1/20 0.49
PPARA Q07869 1/20 0.48

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
SCHEMBL7364676 0.84 REN (0.67) REN
SCHEMBL9770950 0.83 REN (0.59) REN
SCHEMBL10521190 0.83 REN (0.59) REN
SCHEMBL7273591 0.82 REN (0.57) RENCTSDCTSE
SCHEMBL10777061 0.81 REN (0.62) RENCTSDCTSE
SCHEMBL12631595 0.80 REN (0.53) REN
SCHEMBL7436551 0.80 REN (0.55) REN
SCHEMBL13256207 0.80 REN (0.53) REN
SCHEMBL8269721 0.80 REN (0.53) REN
SCHEMBL7363470 0.80 REN (0.66) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4914129-A Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups CIBA-GEIGY CORPORATION (US) 1990-04-03 US disclosed
US-4889869-A ANTIALDOSTERONISM AGENTS CIBA-GEIGY CORPORATION (US) 1989-12-26 US disclosed
US-4758584-A Antihypertensive 5-amino-4-hydroxyvaleryl derivatives substituted by sulphur-containing groups CIBA-GEIGY CORPORATION (US) 1988-07-19 US disclosed
EP-0236734-A2 5-Amino-4-hydroxyvaleryl derivatives substituted by s-containing groups CIBA-GEIGY AG (CH) 1987-09-16 EP disclosed