SCHEMBL7288303

SCHEMBL7288303

CC(C)OC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.47
CTSL P07711 8/20 0.46
CTSB P07858 7/20 0.46
CTSS P25774 4/20 0.46
CTSK P43235 1/20 0.44

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
SCHEMBL7288300 1.00 REN (0.47) RENCTSLCTSBCTSSCTSK
SCHEMBL7268091 0.93 REN (0.46) RENCTSLCTSBCTSSCTSK
SCHEMBL7268094 0.93 REN (0.46) RENCTSLCTSBCTSSCTSK
SCHEMBL9725796 0.91 REN (0.43) RENCTSLCTSS
SCHEMBL9725820 0.91 REN (0.49) RENCTSLCTSBCTSSCTSK
SCHEMBL9725773 0.88 REN (0.46) RENCTSLCTSBCTSSCTSK
SCHEMBL9725744 0.87 REN (0.47) RENCTSLCTSBCTSSCTSK
SCHEMBL9725854 0.86 REN (0.47) RENCTSLCTSBCTSSCTSK
SCHEMBL9725888 0.81 REN (0.47) REN
SCHEMBL7268135 0.79 REN (0.49) 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-0376012-A2 Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1990-07-04 EP disclosed