SCHEMBL31046844

SCHEMBL31046844

CS(=O)(=O)c1cc(S(F)(F)(F)(F)F)ccc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 4/20 0.39
▸ AKR1C2 P52895 4/20 0.39
▸ PTGS2 P35354 4/20 0.39
▸ PTGS1 P23219 2/20 0.39
▸ TAS2R14 Q9NYV8 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ WDR5 P61964 5/20 0.38
▸ KCNQ3 O43525 2/20 0.37
▸ KCNQ2 O43526 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ KCNQ5 Q9NR82 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ ALOX15 P16050 1/20 0.34

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
SCHEMBL31046834 0.88 WDR5 (0.40) AKR1C3AKR1C2PTGS2PTGS1TAS2R14
SCHEMBL4312860 0.77 KEAP1 (0.47) LMNAALDH1A1MAPK1CA1CA2
SCHEMBL23877578 0.76 PTGS1 (0.46) AKR1C3AKR1C2PTGS2PTGS1TAS2R14
SCHEMBL1194182 0.75 ALDH1A1 (0.53) AKR1C3AKR1C2PTGS2PTGS1TAS2R14
SCHEMBL29377565 0.75 ALDH1A1 (0.53) AKR1C3AKR1C2PTGS2PTGS1TAS2R14
SCHEMBL8492726 0.75 CSNK2A1 (0.50) LMNAALDH1A1MAPK1CA1CA2
SCHEMBL1633725 0.75 RXRB (0.46) AKR1C3AKR1C2PTGS2PTGS1TAS2R14
SCHEMBL2126878 0.74 SMN1; SMN2 (0.55) LMNAALDH1A1MAPK1CA1CA2
SCHEMBL1085171 0.74 KDM4E (0.47) LMNAWDR5ALDH1A1MAPK1CA1
SCHEMBL8519995 0.74 ALDH1A1 (0.53) PTGS2LMNAALDH1A1MAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118791407-A Sulfinylamino group benzamide and process for preparing same Sulfonylamino benzamide derivatives 奥索生物公司 2024-10-18 — — CN disclosed
CN-118638096-A Sulfinylamino group benzamide and process for preparing same Sulfonylamino benzamide derivatives 奥索生物公司 2024-09-13 — — CN disclosed
CN-112204008-B Sulfonylaminobenzamides and sulfonylaminobenzamide derivatives 奥索生物公司 2024-07-05 — — CN disclosed
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