SCHEMBL7268409

SCHEMBL7268409

CC(C)(C)OC(=O)[C@](N)(CC1CCCCC1)[C@@](O)(C(=O)C(N)Cc1c[nH]cn1)c1nccs1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.30
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL7268400 0.80 CTSK (0.34) POLBCNR1CNR2
SCHEMBL7268379 0.78 MAPT (0.32) POLB
SCHEMBL9740788 0.77 POLB (0.34) POLB
SCHEMBL7268413 0.75 CTSK (0.38) —
SCHEMBL7268374 0.72 REN (0.41) —
SCHEMBL7268382 0.69 REN (0.46) —
SCHEMBL9741080 0.68 LNPEP (0.31) —
SCHEMBL10714989 0.68 LNPEP (0.32) —
SCHEMBL7782114 0.66 TDP1 (0.35) POLB
SCHEMBL7782118 0.66 TDP1 (0.35) POLB

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-0376040-A2 N-phosphinyl di-and tripeptides as renin inhibitors AMERICAN CYANAMID COMPANY (US) 1990-07-04 — — EP disclosed
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