SCHEMBL2149184

SCHEMBL2149184

CCOC(=O)OCCCCCCCCCCC=CCCCCCCCCN

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.44
ALDH1A1 P00352 3/20 0.43
SLC6A5 Q9Y345 2/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
CNR1 P21554 1/20 0.43
CYP3A4 P08684 2/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 2/20 0.42
CPB2 Q96IY4 1/20 0.41
EPHX2 P34913 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP2C19 P33261 1/20 0.40
SOAT1 P35610 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL6253756 0.89 ALDH1A1 (0.54) ALDH1A1ALOX15TSHRCYP1A2CPB2
SCHEMBL8968839 0.86 FAAH (0.58) FAAHMAPTALOX15HSD17B10CYP1A2
SCHEMBL21448669 0.86 FAAH (0.58) FAAHMAPTALOX15HSD17B10CYP1A2
SCHEMBL8968848 0.86 FAAH (0.58) FAAHMAPTALOX15HSD17B10CYP1A2
SCHEMBL2149938 0.85 FAAH (0.59) FAAHALDH1A1MAPTCNR1CYP3A4
SCHEMBL17056107 0.82 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10CYP1A2CPB2
Sulfuric Acid SCHEMBL9787800 0.81 FAAH (0.53) FAAHMAPTALOX15HSD17B10CYP1A2
Sulfuric Acid SCHEMBL9499818 0.81 FAAH (0.53) FAAHMAPTALOX15HSD17B10CYP1A2
SCHEMBL9069415 0.80 FAAH (0.61) FAAHMAPTCYP3A4ALOX15HSD17B10
SCHEMBL21433832 0.80 FAAH (0.61) FAAHMAPTCYP3A4ALOX15HSD17B10

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-1259478-B1 COVALENT DERIVATIVES OF ALKANOLAMIDES OF MONOCARBOXYLIC AND DICARBOXYLIC ACIDS FUNCTIONALLY ACTIVE ON THE CB2 CANNABINOID RECEPTOR INNOVET ITALIA SRL (IT) 2011-07-13 EP claimed
EP-1259478-B1 COVALENT DERIVATIVES OF ALKANOLAMIDES OF MONOCARBOXYLIC AND DICARBOXYLIC ACIDS FUNCTIONALLY ACTIVE ON THE CB2 CANNABINOID RECEPTOR INNOVET ITALIA SRL (IT) 2011-07-13 EP disclosed