SCHEMBL9725807

SCHEMBL9725807

CC(C)CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)c1cccs1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.52
CTSD P07339 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
SCHEMBL9725801 1.00 REN (0.52) RENCTSD
SCHEMBL9725848 0.88 REN (0.53) REN
SCHEMBL9725846 0.88 REN (0.53) REN
SCHEMBL7269524 0.86 REN (0.52) REN
SCHEMBL7269528 0.86 REN (0.52) REN
SCHEMBL7333295 0.82 REN (0.46) RENCTSD
SCHEMBL7333289 0.82 REN (0.46) RENCTSD
SCHEMBL9555727 0.81 CTSC (0.46) REN
SCHEMBL9555719 0.81 CTSC (0.46) REN
SCHEMBL10339985 0.80 REN (0.50) RENCTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106835-A Hypotensive agents AMERICAN CYANAMID COMPANY (US) 1992-04-21 US claimed