SCHEMBL8338663

SCHEMBL8338663

CCCCCCCCCCCCCCCC(=O)N[C@H](CO)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 2/20 0.68
▸ ALDH1A1 P00352 1/20 0.68
▸ ACER2 Q5QJU3 1/20 0.68
▸ CERT1 Q9Y5P4 3/20 0.66
▸ GPR88 Q9GZN0 1/20 0.54
▸ RIPK1 Q13546 1/20 0.54

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
SCHEMBL7769010 1.00 ASAH1 (0.68) ASAH1ALDH1A1ACER2CERT1GPR88
SCHEMBL7769012 1.00 ASAH1 (0.68) ASAH1ALDH1A1ACER2CERT1GPR88
SCHEMBL6570067 1.00 ASAH1 (0.68) ASAH1ALDH1A1ACER2CERT1GPR88
SCHEMBL28217435 0.90 ASAH1 (0.66) ASAH1ALDH1A1ACER2CERT1
SCHEMBL9848504 0.87 ASAH1 (0.63) ASAH1ALDH1A1ACER2CERT1
SCHEMBL9716121 0.87 ASAH1 (0.63) ASAH1ALDH1A1ACER2CERT1
SCHEMBL27758299 0.85 ASAH1 (0.60) ASAH1ALDH1A1ACER2CERT1
SCHEMBL9716137 0.85 ASAH1 (0.61) ASAH1ALDH1A1ACER2CERT1
SCHEMBL9716138 0.85 ASAH1 (0.61) ASAH1ALDH1A1ACER2CERT1
SCHEMBL7413120 0.85 ASAH1 (0.60) ASAH1ALDH1A1ACER2CERT1

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
US-5990170-A POSSESSES A PROFILE OF ACTIVITY WHICH IS SIMILAR TO, THOUGH LESS POTENT THAN .DELTA.9-THC (TETRAHYDROCANNABINOL) WITH A MIMICKING OF THE PSYCHOACTIVE EFFECTS; ANALGESICS; SIDE EFFECT REDUCTION; CARDIOVASCULAR DISORDERS LIFEGROUP S.P.A. (IT) 1999-11-23 — — US disclosed
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
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