SCHEMBL7311937

SCHEMBL7311937

CC(C)OC(=O)[C@H](O)[C@H](CC1CCCCC1)N(C(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N(C)C)[C@@H](Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 18/20 0.39
▸ CTSL P07711 1/20 0.37
▸ CTSB P07858 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ F2 P00734 1/20 0.35

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
SCHEMBL7320803 0.76 REN (0.57) REN
SCHEMBL9523860 0.74 REN (0.46) REN
SCHEMBL7314665 0.73 REN (0.46) REN
SCHEMBL10653953 0.73 REN (0.44) REN
SCHEMBL7309930 0.73 REN (0.46) REN
SCHEMBL7319702 0.72 REN (0.43) REN
SCHEMBL7326621 0.72 REN (0.42) REN
SCHEMBL10420912 0.72 REN (0.58) REN
Hydrochloric Acid SCHEMBL7323642 0.71 REN (0.42) REN
SCHEMBL7316219 0.71 REN (0.41) 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-5135914-A Controlling hypertension, hyperaldosteronism, and congestive heart failure WARNER-LAMBERT COMPANY (US) 1992-08-04 — — US disclosed
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