SCHEMBL27962292

SCHEMBL27962292

O=S(=O)(O)CS(=O)(=O)Oc1c(F)cccc1F

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
PKM P14618 1/20 0.32
PKLR P30613 1/20 0.32
EPAS1 Q99814 1/20 0.31
LMNA P02545 1/20 0.31
BCHE P06276 1/20 0.31
SLC2A1 P11166 1/20 0.30
SLC2A4 P14672 1/20 0.30
KMT2A Q03164 1/20 0.30
CXCL8 P10145 1/20 0.30
PSIP1 O75475 1/20 0.30

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
SCHEMBL15763961 0.88 PKM (0.35) CES2CES1PKMPKLREPAS1
SCHEMBL27962297 0.84 CES2 (0.38) CES2CES1
SCHEMBL27962304 0.81 CES2 (0.31) CES2CES1
SCHEMBL27962288 0.81 SLC6A2 (0.36) CES2CES1BCHECXCL8
Hydrazine SCHEMBL28200764 0.75 CES2 (0.37) CES2CES1PKMPKLREPAS1
SCHEMBL27962301 0.71 CES2 (0.33) CES2CES1LMNA
SCHEMBL28811823 0.71 SOS1 (0.42) CES2CES1EPAS1
SCHEMBL26664898 0.71 ELANE (0.42) CES2CES1PKMPKLREPAS1
SCHEMBL15763978 0.71 CES2 (0.39) CES2CES1
SCHEMBL11038851 0.71 KMT2A (0.57) LMNAKMT2A

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-103748730-A Nonaqueous electrolyte solution and electricity storage device using same UBE INDUSTRIES 2014-04-23 CN disclosed