SCHEMBL28629893

SCHEMBL28629893

CCCCCCCCCCCC(F)(CCCCCCCCC)S(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.48
LPAR1 Q92633 1/20 0.48
LPAR3 Q9UBY5 1/20 0.48
EPHX1 P07099 2/20 0.47
CES1 P23141 9/20 0.43
FAAH O00519 9/20 0.43
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GGPS1 O95749 1/20 0.42

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
SCHEMBL28621393 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL29166818 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL29282843 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL29166403 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL28625404 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL28627713 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL28628965 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL31249509 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL29166718 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1
SCHEMBL28630173 1.00 CES2 (0.48) CES2LPAR1LPAR3EPHX1CES1

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-113252759-A Electrochemical gas sensor and electrolyte for electrochemical gas sensor 德尔格安全股份两合公司 2021-08-13 CN disclosed