SCHEMBL27428336

SCHEMBL27428336

CC(C)(O)O.CCCCCCCCCCCCCCCCC(C(=O)O)S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.47
FFAR1 O14842 1/20 0.47
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
HSPD1 P10809 1/20 0.44
BLM P54132 1/20 0.44
HSPE1 P61604 1/20 0.44
GRIK1 P39086 2/20 0.44
GRIK2 Q13002 2/20 0.44
ACE2 Q9BYF1 1/20 0.43
TP53 P04637 1/20 0.42
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
CA2 P00918 1/20 0.41
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 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
SCHEMBL1158129 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8572246 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3495447 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9437254 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1157909 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8574512 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3495263 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7609463 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL29411296 0.93 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28201959 0.93 GPR84 (0.53) 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
CN-1087670-A Detergent composition having low skin irritability LION CORP (JP) 1994-06-08 CN disclosed