SCHEMBL6533876

SCHEMBL6533876

CCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)C(CC)N(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.43
FAAH O00519 2/20 0.42
TRPV1 Q8NER1 1/20 0.42
SPHK2 Q9NRA0 2/20 0.41
SPHK1 Q9NYA1 2/20 0.41
CETP P11597 1/20 0.41
DNM1 Q05193 1/20 0.39
GMNN O75496 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
APEX1 P27695 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL6532061 1.00 EPHX2 (0.43) EPHX2FAAHTRPV1SPHK2SPHK1
SCHEMBL20590751 0.89 DNM1 (0.48) DNM1
Hydrochloric Acid SCHEMBL29286816 0.87 DNM1 (0.50) DNM1
SCHEMBL25219271 0.76 EPHX2 (0.44) EPHX2FAAHTRPV1GMNNUSP2
SCHEMBL8345479 0.74 DNM1 (0.71) EPHX2FAAHTRPV1DNM1GMNN
SCHEMBL22063799 0.74 FAAH (0.54) EPHX2FAAHTRPV1DNM1GMNN
SCHEMBL1333273 0.74 DNM1 (0.71) EPHX2FAAHTRPV1DNM1GMNN
SCHEMBL21240011 0.74 DNM1 (0.71) EPHX2FAAHTRPV1DNM1GMNN
SCHEMBL165446 0.74 DNM1 (0.71) EPHX2FAAHTRPV1DNM1GMNN
SCHEMBL23606003 0.74 FAAH (0.54) EPHX2FAAHTRPV1DNM1GMNN

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
EP-1499790-B1 THICKENED ACID COMPOSITIONS AND USES THEREOF AKZO NOBEL NV (NL) 2005-11-16 EP claimed