SCHEMBL8776663

SCHEMBL8776663

CCCCCCCCCCCCCCCC(=O)NCC(O)c1ccccc1.NCC(O)c1ccccc1

nearest known ligand 0.87

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 2/20 0.87
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
LMNA P02545 1/20 0.56
CERT1 Q9Y5P4 3/20 0.56
ALDH1A1 P00352 1/20 0.54
ACER2 Q5QJU3 1/20 0.54
EPHX2 P34913 2/20 0.53
BCAT2 O15382 1/20 0.51
NAAA Q02083 2/20 0.48
FAAH O00519 1/20 0.47
MMP2 P08253 1/20 0.47

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
SCHEMBL8335749 0.93 ASAH1 (1.00) ASAH1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL17343770 0.88 ASAH1 (0.89) ASAH1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL9848444 0.84 ASAH1 (0.69) ASAH1CERT1ALDH1A1ACER2EPHX2
SCHEMBL9848372 0.84 ASAH1 (0.69) ASAH1CERT1ALDH1A1ACER2EPHX2
SCHEMBL12435702 0.84 ASAH1 (0.81) ASAH1ALDH1A1EPHX2FAAH
SCHEMBL12672800 0.81 ASAH1 (0.76) ASAH1NPC1RAB9ASMN1; SMN2BCAT2
SCHEMBL18741947 0.81 ASAH1 (0.76) ASAH1CERT1ALDH1A1ACER2EPHX2
SCHEMBL21634180 0.80 ASAH1 (0.75) ASAH1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1233061 0.80 ASAH1 (0.75) ASAH1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL6646425 0.76 ASAH1 (0.68) ASAH1SMN1; SMN2ALDH1A1ACER2EPHX2

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-0799033-A1 USE OF MONO AND BICARBOXYLIC ACID AMIDES FOR THE MANUFACTURE OF A MEDICAMENT ACTIVE AT THE PERIPHERAL CANNABINOID RECEPTOR LIFEGROUP S.p.A. (IT) 1997-10-08 EP disclosed
WO-1996018391-A2 USE OF MONO AND BICARBOXYLIC ACID AMIDES FOR THE MANUFACTURE OF A MEDICAMENT ACTIVE AT THE PERIPHERAL CANNABINOID RECEPTOR LIFEGROUP S.P.A. (IT) 1996-06-20 WO disclosed