SCHEMBL20274644

SCHEMBL20274644

CCCCCCCCCCCCN(CC(C)O)C(=O)C(O)CCCCCC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
SPHK1 Q9NYA1 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 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
SCHEMBL22631845 0.88 GPR84 (0.52) GPR84FFAR1FFAR4CA12CA1
Ethylene SCHEMBL29186282 0.84 GPR84 (0.55) GPR84FFAR1FFAR4CA12CA1
SCHEMBL9116790 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL2492928 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL7786148 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL7783905 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL2502264 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL21018932 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL9115425 0.84 GPR84 (0.47) GPR84FFAR1FFAR4SPHK1
SCHEMBL9156532 0.81 GPR84 (0.50) GPR84FFAR1CA12CA1CA2

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-2662071-B1 COSMETIC comprising a ceramide KAO CORP (JP) 2018-06-20 EP disclosed