SCHEMBL7302206

SCHEMBL7302206

COCCCOc1cc(C[C@@H](C[C@H](N)[C@@H](O)C[C@H](C(=O)NCC(=O)NN2CCOCC2)C(C)C)C(C)C)ccc1OC

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.77

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
Hydrochloric Acid SCHEMBL7304565 0.99 REN (0.78) REN
SCHEMBL7344630 0.90 REN (0.79) REN
Hydrochloric Acid SCHEMBL7409077 0.90 REN (0.80) REN
Hydrochloric Acid SCHEMBL8682904 0.89 REN (0.79) REN
SCHEMBL6044313 0.89 REN (0.77) REN
Hydrochloric Acid SCHEMBL6044455 0.88 REN (0.78) REN
SCHEMBL7307162 0.87 REN (0.99) REN
SCHEMBL1596156 0.87 REN (0.79) REN
SCHEMBL6044837 0.87 REN (0.61) REN
Hydrochloric Acid SCHEMBL6044556 0.87 REN (1.00) 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-0678503-A1 Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities CIBA-GEIGY AG (CH) 1995-10-25 EP claimed