SCHEMBL806180

SCHEMBL806180

CC(C)(C)OC(=O)NC(C(=O)N1CCC[C@H]1C(N)=O)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.42
CMA1 P23946 7/20 0.41
ACE P12821 1/20 0.41
KLK5 Q9Y337 1/20 0.40
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39

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
SCHEMBL14232792 1.00 ELANE (0.42) ELANECMA1ACEKLK5F2
SCHEMBL8055611 1.00 ELANE (0.42) ELANECMA1ACEKLK5F2
SCHEMBL26121717 0.89 ACE (0.51) ELANECMA1ACEF2
SCHEMBL159043 0.89 ACE (0.51) ELANECMA1ACEF2
SCHEMBL806133 0.89 ACE (0.51) ELANECMA1ACEF2
SCHEMBL1300341 0.89 ACE (0.51) ELANECMA1ACEF2
SCHEMBL8140568 0.88 ELANE (0.39) ELANECMA1
SCHEMBL14202917 0.88 KLK5 (0.51) ELANECMA1ACEKLK5
SCHEMBL8046113 0.88 KLK5 (0.51) ELANECMA1ACEKLK5
SCHEMBL14235324 0.87 CMA1 (0.44) ELANECMA1ACEKLK5F2

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
WO-2012037259-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2012-03-22 WO disclosed
WO-2011041551-A1 THERAPEUTIC ANTIVIRAL PEPTIDES INTERMUNE, INC. (US) 2011-04-07 WO disclosed