SCHEMBL9876205

SCHEMBL9876205

CNC(=O)[C@H](Cc1ccc(OC)cc1)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.55
CACNA1B Q00975 2/20 0.47
MMP1 P03956 1/20 0.46

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
SCHEMBL8458792 0.91 REN (0.57) RENCACNA1B
SCHEMBL8462589 0.91 REN (0.57) RENCACNA1B
SCHEMBL9876381 0.90 REN (0.56) REN
SCHEMBL27692373 0.90 REN (0.56) REN
SCHEMBL10672536 0.90 REN (0.66) REN
SCHEMBL7363470 0.90 REN (0.66) REN
SCHEMBL9876268 0.87 REN (0.55) REN
SCHEMBL27673654 0.87 REN (0.55) REN
SCHEMBL9876526 0.84 REN (0.55) REN
SCHEMBL27692371 0.84 REN (0.55) 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-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
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