SCHEMBL6696129

SCHEMBL6696129

CC(C)CCCCCCC(N)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.52
TRPA1 O75762 1/20 0.52
LMNA P02545 2/20 0.46
SPHK1 Q9NYA1 2/20 0.44
CYP2D6 P10635 2/20 0.37
BLM P54132 2/20 0.37
TP53 P04637 2/20 0.37
GMNN O75496 1/20 0.37
POLB P06746 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CETP P11597 1/20 0.37
HTT P42858 1/20 0.37
UBE2N P61088 1/20 0.37
OPRM1 P35372 1/20 0.36
LTA4H P09960 1/20 0.34

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
SCHEMBL6570850 1.00 TRPV1 (0.52) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL6698430 1.00 TRPV1 (0.52) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL7695863 0.97 TRPV1 (0.48) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL28062246 0.97 TRPV1 (0.48) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL6682836 0.92
SCHEMBL10798330 0.85 TRPV1 (0.50) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL23623625 0.83 TRPV1 (0.52) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL15571898 0.83 OPRM1 (0.55) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL18571463 0.82 TRPV1 (0.45) TRPV1TRPA1LMNASPHK1CYP2D6
SCHEMBL1779196 0.79

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
JP-2004533516-A 2004-11-04 JP claimed
EP-1397468-A1 METHOD OF REFINING CRUDE OILS HAVING HIGH ORGANIC ACIDITY Total France (FR) 2004-03-17 EP claimed
WO-2002097014-A1 METHOD OF REFINING CRUDE OILS HAVING HIGH ORGANIC ACIDITY TOTAL FRANCE (FR) 2002-12-05 WO claimed