SCHEMBL9956940

SCHEMBL9956940

CCCCCCCC/C=C\CCCCCCC(C)C(=O)OCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.52
EPHX2 P34913 2/20 0.48
GMNN O75496 1/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
ALOX15 P16050 1/20 0.46
APEX1 P27695 1/20 0.46
CYP2C19 P33261 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL16718899 0.95 DUSP3 (0.50)
SCHEMBL13949564 0.94 FAAH (0.46) FAAHGMNNUSP2LMNACYP1A2
Oleic Acid SCHEMBL28418995 0.92 PPARG (0.62) FAAHEPHX2GMNNUSP2LMNA
SCHEMBL6825961 0.91 MGLL (0.55) FAAHEPHX2
SCHEMBL6825960 0.91 MGLL (0.55) FAAHEPHX2
SCHEMBL6825958 0.91 MGLL (0.55) FAAHEPHX2
SCHEMBL15294513 0.90 CA1 (0.53) FAAHLMNAMAPTNPSR1
SCHEMBL7223700 0.90 CA1 (0.53) FAAHLMNAMAPTNPSR1
SCHEMBL7224048 0.90 CA1 (0.53) FAAHLMNAMAPTNPSR1
SCHEMBL7218790 0.90 CA1 (0.53) FAAHLMNAMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012085864-A1 ENCAPSULATES PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2012-06-28 WO disclosed