SCHEMBL13309792

SCHEMBL13309792

COCCCOc1cc(C[C@@H](CC(N)[C@@H](C)CN2CCCNC2=O)C(C)C)ccc1OC

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.52

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
SCHEMBL8286635 1.00 REN (0.52) REN
SCHEMBL5754839 0.92 REN (0.58) REN
Hydrochloric Acid SCHEMBL3298976 0.91 REN (0.60) REN
SCHEMBL3271541 0.82 REN (0.52) REN
SCHEMBL13344752 0.80 REN (0.60) REN
SCHEMBL13344746 0.80 REN (0.62) REN
Hydrochloric Acid SCHEMBL3270996 0.79 REN (0.61) REN
Hydrochloric Acid SCHEMBL5157404 0.79 REN (0.63) REN
Hydrochloric Acid SCHEMBL5157410 0.79 REN (0.63) REN
Hydrochloric Acid SCHEMBL3270990 0.79 REN (0.61) 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
EP-1735270-B1 DIAMINO ALCOHOLS AND THEIR USE AS RENIN INHIBITORS NOVARTIS AG (CH) 2010-06-30 EP disclosed