SCHEMBL8095963

SCHEMBL8095963

CCCCCCCCCCCCCCOC(=O)CCCCCCNC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.62
EPHX2 P34913 6/20 0.55
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
NAAA Q02083 1/20 0.53
ACHE P22303 6/20 0.53
PAM P19021 2/20 0.53
FAAH O00519 1/20 0.53
DNM1 Q05193 1/20 0.53

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
SCHEMBL7898787 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7898134 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7900167 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7901887 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7898725 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7900172 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7890486 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7901960 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7898235 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3
SCHEMBL7901777 0.93 DGKA (0.54) DGKAEPHX2PRSS1PRSS2PRSS3

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-0973710-A2 OMEGA-AMINO ACID DERIVATIVES, PROCESSES OF THEIR PREPARATION AND THEIR USE Bochemie S.R.O. (CZ) 2000-01-26 EP disclosed
WO-1998045233-A2 OMEGA-AMINO ACID DERIVATIVES, PROCESSES OF THEIR PREPARATION AND THEIR USE BOCHEMIE S.R.O. (CZ) 1998-10-15 WO disclosed