SCHEMBL7358701

SCHEMBL7358701

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

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 18/20 0.60
CTSS P25774 1/20 0.48
CTSK P43235 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
SCHEMBL7281729 0.91 REN (0.56) RENCTSSCTSK
SCHEMBL27673686 0.89 REN (0.61) RENCTSSCTSK
SCHEMBL10669316 0.89 REN (0.61) RENCTSSCTSK
SCHEMBL10675193 0.89 REN (0.61) RENCTSSCTSK
SCHEMBL7359298 0.89 REN (0.61) RENCTSSCTSK
SCHEMBL9876551 0.88 REN (0.56) RENCTSSCTSK
SCHEMBL10587538 0.85 REN (0.54) RENCTSSCTSK
SCHEMBL7326076 0.85 REN (0.51) RENCTSSCTSK
SCHEMBL7266599 0.84 REN (0.58) RENCTSSCTSK
SCHEMBL7272241 0.84 REN (0.58) RENCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992562-A Renin inhibitors containing 5-amino-2,5-disubstituted-4-hydroxypentanoic acid residues PFIZER INC. (US) 1991-02-12 US disclosed
US-4948913-A Renin inhibitors containing 5-amino-2,5-disubstituted-4-hydroxypentanoic acid residues PFIZER INC. (US) 1990-08-14 US disclosed
WO-1988003022-A1 RELATIVELY LOW MOLECULAR WEIGHT POLYPEPTIDES AS RENIN INHIBITORS PFIZER INC. (US) 1988-05-05 WO disclosed
US-4729985-A Renin inhibitors containing 5-amino-2,5-disubstituted-4-hydroxypentanoic acid residues PFIZER INC. (US) 1988-03-08 US disclosed
EP-0212903-A2 Polypeptide derivatives containing 5-amino-2,5-disubstituted-4-hydroxypentanoic acid residues PFIZER INC. (US) 1987-03-04 EP disclosed