SCHEMBL7300719

SCHEMBL7300719

O=C(O[C@@H](Cc1ccccc1)C(=O)NC(=O)[C@H](Cc1c[nH]cn1)N[C@@H](CC1CCCCC1)[C@@H](O)c1ncc[nH]1)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.39

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
SCHEMBL7300714 0.90 REN (0.47) REN
SCHEMBL7318279 0.88 REN (0.52) REN
SCHEMBL7376819 0.88 REN (0.41) REN
SCHEMBL7381238 0.87 REN (0.43) REN
SCHEMBL7387593 0.86 REN (0.49) REN
SCHEMBL7376537 0.84 REN (0.41) REN
SCHEMBL7367557 0.81 REN (0.52) REN
SCHEMBL7369515 0.81 REN (0.56) REN
SCHEMBL7293684 0.80 REN (0.50) REN
SCHEMBL7385934 0.80 REN (0.42) 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-5151513-A N-HETEROCYCLIC ALCOHOL DERIVATIVES E. R. SQUIBB & SONS, INC. (US) 1992-09-29 US disclosed
EP-0341481-A1 N-heterocyclic alcohol derivatives E.R. Squibb & Sons, Inc. (US) 1989-11-15 EP disclosed