SCHEMBL9014828

SCHEMBL9014828

CCCCNS(=O)(=O)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)N[C@@H](Cc1cncn1COCc1ccccc1)C(=O)NC(=O)C(Cc1ccccc1)CS(=O)(=O)C(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.60

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
SCHEMBL9632647 0.90 REN (0.53) REN
SCHEMBL9014850 0.88 REN (0.58) REN
SCHEMBL7272808 0.88 REN (0.58) REN
SCHEMBL9014840 0.86 REN (0.57) REN
SCHEMBL7270739 0.85 REN (0.58) REN
SCHEMBL7278484 0.83 REN (0.81) REN
SCHEMBL7270874 0.82 REN (0.67) REN
SCHEMBL9014845 0.82 REN (0.70) REN
SCHEMBL9014944 0.79 REN (0.52) REN
SCHEMBL9014916 0.74 REN (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545838-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1996-08-13 US disclosed