SCHEMBL8769600

SCHEMBL8769600

CC(=O)NC(B1OC(C)(C)C(C)(C)O1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.39
LAP3 P28838 2/20 0.39
ELANE P08246 4/20 0.37

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
SCHEMBL23969648 0.71 ANPEP (0.44) ANPEPLAP3ELANE
SCHEMBL23969594 0.71 ANPEP (0.44) ANPEPLAP3ELANE
SCHEMBL23969671 0.71 CA1 (0.39) ELANE
SCHEMBL24224257 0.70 DPP7 (0.41) ELANE
SCHEMBL23969575 0.70 CTSK (0.48)
SCHEMBL24702740 0.68 F2 (0.39) ANPEPLAP3
SCHEMBL21762131 0.64 ANPEP (0.41) ANPEPLAP3
SCHEMBL20510145 0.63 ANPEP (0.64) ANPEPLAP3
SCHEMBL10592640 0.63 ANPEP (0.64) ANPEPLAP3
SCHEMBL20510143 0.62 ANPEP (0.35) ANPEPLAP3

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-0636143-B1 ALPHA-AMINOBORONIC ACID PEPTIDES AND THEIR USE AS ELASTASE INHIBITORS ZENECA LTD (GB) 1997-09-24 EP claimed
EP-0636143-B1 ALPHA-AMINOBORONIC ACID PEPTIDES AND THEIR USE AS ELASTASE INHIBITORS ZENECA LTD (GB) 1997-09-24 EP disclosed