SCHEMBL8525693

SCHEMBL8525693

CC(C)(C)OC(=O)N(/C(N)=N\[N+](=O)[O-])[C@H](CCCN)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 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
SCHEMBL1022347 0.82 CPB2 (0.40) CPB2
SCHEMBL3662433 0.82 CPB2 (0.40) CPB2
SCHEMBL3662436 0.82 CPB2 (0.40) CPB2
SCHEMBL7416589 0.78 CPB2 (0.42) CPB2
SCHEMBL1039473 0.78 CPB2 (0.42) CPB2
SCHEMBL2211497 0.78 CPB2 (0.42) CPB2
Ethylenediamine SCHEMBL17669759 0.77 CPB2 (0.41) CPB2
Ethylenediamine SCHEMBL17669758 0.77 CPB2 (0.41) CPB2
Glycerin SCHEMBL28491442 0.75 CPB2 (0.34) CPB2
SCHEMBL9199436 0.73 HTR2A (0.35) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885186-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1998-12-23 — — EP disclosed
WO-1997019911-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1997-06-05 — — WO disclosed
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