SCHEMBL3736307

SCHEMBL3736307

CS(=O)(=O)Oc1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.45
CA2 P00918 6/20 0.44
CA9 Q16790 4/20 0.44
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
MMP2 P08253 2/20 0.43
MMP7 P09237 2/20 0.43
MMP9 P14780 2/20 0.43
MMP14 P50281 2/20 0.43
MMP1 P03956 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
PPARA Q07869 5/20 0.41
AKR1C3 P42330 1/20 0.41
MMP3 P08254 1/20 0.40
MMP8 P22894 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
ENPP3 O14638 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
SCHEMBL575589 0.87 CA2 (0.52) CA2CA9CA12CA1MMP2
SCHEMBL8887826 0.87 STS (0.55) CA2CA9CA12CA1ALDH1A1
SCHEMBL3838977 0.80 CA2 (0.58) CA2CA9CA12CA1MMP2
SCHEMBL779427 0.80 SOS1 (0.48) SOS1CA2CA9CA12CA1
SCHEMBL3710207 0.80 PTGS2 (0.57) CA2CA9CA12CA1ALDH1A1
SCHEMBL3710205 0.80 PTGS2 (0.57) CA2CA9CA12CA1ALDH1A1
SCHEMBL31634374 0.78 SOS1 (0.47) SOS1CA2CA9CA12CA1
SCHEMBL6941035 0.78 CA1 (0.64) CA2CA9CA12CA1MMP2
SCHEMBL168170 0.78 CA2 (0.64) CA2CA9CA12CA1MMP2
SCHEMBL9529411 0.78 SOS1 (0.47) SOS1CA2CA9CA12CA1

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8512897-B2 Phenyl sulfonate compound, nonaqueous electrolyte solution using the same, and lithium battery UBE INDUSTRIES, LTD. (JP) 2013-08-20 US claimed
CN-101842349-B Phenyl sulfonate compound, nonaqueous electrolyte solution using the same, and lithium battery UBE INDUSTRIES 2013-07-17 CN claimed
US-6737550-B2 LITHIUM SALT OF 4- FLUOROPHENYL METHYL SULFONE AS THE CHEMICAL INTERMEDIATE; DRUG WITH ANTIANDROGEN ACTIVITY BIOGAL GRYOGYSZERGYAR RT. (HU) 2004-05-18 US claimed
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-11897857-B2 Isotopically-stabilized tetronimide compounds MIDWESTERN UNIVERSITY (US) 2024-02-13 US disclosed
CN-111196781-B Improved method for preparing pentafluoride 湖南中南制药有限责任公司 2023-07-28 CN 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
US-20210094927-A1 ISOTOPICALLY-STABILIZED TETRONIMIDE COMPOUNDS MIDWESTERN UNIVERSITY 2021-04-01 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-10374256-B2 Nonaqueous electrolyte solution, electricity storage device using same, and phosphonoformic acid compound used in same UBE INDUSTRIES, LTD. (JP) 2019-08-06 US disclosed
CN-1871212-A Process for producing triarylsulfonium salt WAKO PURE CHEM IND LTD (JP) 2006-11-29 CN disclosed
CN-1854133-A Heterocycle-bearing onium salts WAKO PURE CHEM IND LTD (JP) 2006-11-01 CN disclosed
CN-1678574-A Process for producing aminoalkylsulfonic acid and method of salt exchange for salt thereof WAKO PURE CHEM IND LTD (JP) 2005-10-05 CN disclosed
CN-1622943-A Heterocyclic onium salt WAKO PURE CHEM IND LTD (JP) 2005-06-01 CN disclosed
CN-1578766-A Hybrid onium salt WAKO PURE CHEM IND LTD (JP) 2005-02-09 CN disclosed
EP-0648723-B1 Diphenylacetylene compound, process for preparing the same and liquid crystal composition and element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-05-20 EP disclosed
US-5658489-A EXCELLENT ANISOTROPY OF REFRACTIVE INDEX; LOW VISCOSITY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-19 US disclosed
EP-0648723-A1 Diphenylacetylene compound, process for preparing the same and liquid crystal composition and element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed
CN-1091432-A Can suppress the active peptide of hiv protease, its preparation with and medical use SANKYO CO (JP) 1994-08-31 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11897857-B2 Isotopically-stabilized tetronimide compounds ASPH, BACE1, DNPEP SOS1 1087/4885CA2 2174/4885CA9 2215/4885
US-20210094927-A1 ISOTOPICALLY-STABILIZED TETRONIMIDE COMPOUNDS ASPH, BACE1, DNPEP SOS1 1087/4885CA2 2174/4885CA9 2215/4885
US-10374256-B2 Nonaqueous electrolyte solution, electricity storage device using same, and phosphonoformic acid compound used in same HCN2, PHOSPHO1, HCN1 SOS1 4207/4885CA2 454/4885CA9 2456/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.