SCHEMBL8835904

SCHEMBL8835904

COCCCOc1cc(C[C@@H](C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)C[C@H](C(=O)NCCN2CCOCC2)C(C)C)C(C)C)ccc1OCCCO

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.68

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
SCHEMBL8835898 1.00 REN (0.68) REN
SCHEMBL6044336 0.95 REN (0.75) REN
SCHEMBL8905759 0.95 REN (0.75) REN
SCHEMBL6045342 0.92 REN (0.76) REN
SCHEMBL6044506 0.89 REN (0.75) REN
SCHEMBL6044511 0.89 REN (0.75) REN
SCHEMBL6044793 0.88 REN (0.76) REN
SCHEMBL6045122 0.87 REN (0.66) REN
SCHEMBL6044886 0.87 REN (0.88) REN
Hydrochloric Acid SCHEMBL8835576 0.86 REN (0.90) 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-5606078-A ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-02-25 US disclosed
EP-0678514-A1 3,5-Disubstituted tetrahydrofuran-2-ones CIBA-GEIGY AG (CH) 1995-10-25 EP disclosed