SCHEMBL7105885

SCHEMBL7105885

CCCCCC(CC)(CC)C(=O)C(CC)(CC)CCCCC

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.48
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
FDPS P14324 10/20 0.41
GGPS1 O95749 7/20 0.41
CES1 P23141 1/20 0.40
EPHX1 P07099 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
SCHEMBL8595299 0.87 CES2 (0.56) CES2FDPSGGPS1CES1EPHX1
SCHEMBL6682242 0.87 CES2 (0.56) CES2FDPSGGPS1CES1EPHX1
SCHEMBL28626290 0.83 CES2 (0.52) CES2FDPSGGPS1CES1EPHX1
SCHEMBL2138523 0.83 CYP4F2 (0.42) CES2CYP4F2CYP4A11
SCHEMBL29406337 0.83 CYP4F2 (0.42) CES2CYP4F2CYP4A11FDPSGGPS1
Acetone SCHEMBL7095608 0.83 CES2 (0.52) CES2FDPSGGPS1CES1EPHX1
SCHEMBL3417789 0.83 CYP4F2 (0.42) CES2CYP4F2CYP4A11
SCHEMBL2340906 0.83 CYP4F2 (0.42) CES2CYP4F2CYP4A11FDPSGGPS1
Acetone SCHEMBL3264802 0.83 CES2 (0.52) CES2FDPSGGPS1CES1EPHX1
SCHEMBL1922883 0.81 FDPS (0.35) CES2CYP4F2CYP4A11FDPSCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0914516-B1 PROCESS FOR THE REDUCTIVE POST-CLEANING OF POLYESTER-CONTAINING TEXTILES BASF AG (DE) 2003-10-01 EP disclosed
EP-0914516-A1 PROCESS FOR THE REDUCTIVE POST-CLEANING OF POLYESTER-CONTAINING TEXTILES BASF AKTIENGESELLSCHAFT (DE) 1999-05-12 EP disclosed
WO-1998003725-A1 PROCESS FOR THE REDUCTIVE POST-CLEANING OF POLYESTER-CONTAINING TEXTILES BASF AKTIENGESELLSCHAFT (DE) 1998-01-29 WO disclosed