SCHEMBL20965613

SCHEMBL20965613

C=Cc1c(S(=O)(=O)O)ccc(C(=O)OC(=O)c2ccc(S(=O)(=O)O)c(C=C)c2F)c1F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL18762991 0.82 CES2 (0.39) CES2CES1
SCHEMBL20965611 0.78 MEN1 (0.33) CES2CES1ALDH1A1
SCHEMBL18762922 0.78 CA1 (0.36) TDP1ALDH1A1
SCHEMBL20965607 0.75 ALDH1A1 (0.34) TDP1CES2CES1ALDH1A1
SCHEMBL31107811 0.75 CES2 (0.34) TDP1CES2CES1
SCHEMBL18762928 0.74 CES2 (0.30) CES2CES1
SCHEMBL18762959 0.73 CA1 (0.38) CES2CES1
SCHEMBL576368 0.70 CES2 (0.41) CES2CES1ALDH1A1
SCHEMBL576237 0.70 CES2 (0.41) CES2CES1
SCHEMBL18762965 0.69 ALDH1A1 (0.33) TDP1CES2CES1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12255288-B2 Nonaqueous electrolytic solution for battery and lithium secondary battery MITSUI CHEMICALS, INC. (JP) 2025-03-18 US disclosed
US-12095037-B2 Non-aqueous electrolyte solution for battery and lithium secondary battery MITSUI CHEMICALS, INC. (JP) 2024-09-17 US disclosed
US-20220158247-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR BATTERY AND LITHIUM SECONDARY BATTERY MITSUI CHEMICALS, INC. (JP) 2022-05-19 US disclosed
EP-3951950-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR BATTERIES, AND LITHIUM SECONDARY BATTERY Mitsui Chemicals, Inc. (JP) 2022-02-09 EP disclosed
US-20210296703-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR BATTERY AND LITHIUM SECONDARY BATTERY MITSUI CHEMICALS, INC. (JP) 2021-09-23 US disclosed
EP-3828981-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR BATTERIES AND LITHIUM SECONDARY BATTERY Mitsui Chemicals, Inc. (JP) 2021-06-02 EP disclosed
US-10290900-B2 Non-aqueous electrolytic solution and lithium ion secondary battery comprising same NIPPON SHOKUBAI CO., LTD. (JP) 2019-05-14 US disclosed