SCHEMBL4136202

SCHEMBL4136202

O=S(OC1(c2ccccc2)CCCCC1F)OC1(c2ccccc2)CCCCC1F

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.42
SLC6A4 P31645 3/20 0.42
OPRM1 P35372 1/20 0.42
MAOB P27338 3/20 0.35
AKR1C1 Q04828 1/20 0.34
SLC6A3 Q01959 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4136197 0.88 SLC6A2 (0.40) SLC6A2SLC6A4OPRM1MAOBAKR1C1
SCHEMBL4122079 0.77 SLC6A2 (0.40) SLC6A2SLC6A4OPRM1MAOBAKR1C1
SCHEMBL10978826 0.70 SLC6A2 (0.38) SLC6A2SLC6A4OPRM1MAOBAKR1C1
SCHEMBL4142028 0.70 SLC6A4 (0.34) SLC6A4OPRM1MAOBSLC6A3MAPK1
SCHEMBL778788 0.70 AKR1C1 (0.42) SLC6A2SLC6A4OPRM1AKR1C1SLC6A3
SCHEMBL4139866 0.69 CHRM3 (0.33) MAOB
SCHEMBL9233208 0.68 MAOB (0.48) SLC6A2SLC6A4MAOBSLC6A3
SCHEMBL776171 0.68 AKR1C1 (0.41) SLC6A2SLC6A4OPRM1AKR1C1SLC6A3
SCHEMBL10977602 0.67 SLC6A2 (0.38) SLC6A2SLC6A4MAOBAKR1C1SLC6A3
SCHEMBL576549 0.67 SLC6A2 (0.38) SLC6A2SLC6A4OPRM1MAOBSLC6A3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20220149436-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2022-05-12 US disclosed
US-11283107-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-22 US disclosed
EP-3621141-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2020-03-11 EP disclosed
US-20190229372-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2019-07-25 US disclosed
US-10333172-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-25 US disclosed
US-10290901-B2 2019-05-14 US disclosed
US-20170084955-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2017-03-23 US disclosed
US-20150056503-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-26 US disclosed
EP-2012386-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2009-01-07 EP disclosed