SCHEMBL9567331

SCHEMBL9567331

CCCCCCC(C(=O)O)[S+](C)[O-]

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.52
FFAR1 O14842 2/20 0.52
MAPT P10636 1/20 0.50
LCK P06239 1/20 0.50
PPARD Q03181 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
ACE2 Q9BYF1 1/20 0.47
CA2 P00918 1/20 0.44
GRIK1 P39086 2/20 0.43
GRIK2 Q13002 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
CA1 P00915 2/20 0.42
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41

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
SCHEMBL11144567 1.00 GPR84 (0.52) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11766362 0.84 CA1 (0.45) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11139537 0.83 EPHX1 (0.44) GPR84FFAR1MAPTLCKPPARD
SCHEMBL17255842 0.83 GPR84 (0.50) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11143871 0.80 ZDHHC7 (0.54) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11146723 0.80 ZDHHC7 (0.42) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9567341 0.80 ZDHHC7 (0.54) GPR84FFAR1MAPTLCKPPARD
SCHEMBL11146726 0.80 ZDHHC7 (0.54) GPR84FFAR1MAPTLCKPPARD
Butane SCHEMBL6828632 0.79 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
Butane SCHEMBL10345671 0.79 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD

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-0576287-A1 Cosmetic compositions UNILEVER PLC (GB) 1993-12-29 EP disclosed