SCHEMBL10825115

SCHEMBL10825115

CC(C)CC(NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(O)CN[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.71

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
SCHEMBL10825262 1.00 REN (0.71) REN
SCHEMBL10825122 0.94 REN (0.73) REN
SCHEMBL10825186 0.94 REN (0.62) REN
SCHEMBL10825165 0.94 REN (0.62) REN
SCHEMBL10659930 0.87 REN (0.67) REN
SCHEMBL10825253 0.86 REN (0.57) REN
SCHEMBL10825102 0.86 REN (0.57) REN
SCHEMBL10825108 0.86 REN (0.57) REN
SCHEMBL10656810 0.86 REN (0.75) REN
SCHEMBL10825176 0.84 REN (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4629724-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1986-12-16 — — US claimed
US-4629724-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1986-12-16 — — US disclosed
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