SCHEMBL23141189

SCHEMBL23141189

O=C(O)c1cc(S(F)(F)(F)(F)F)ccc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 7/20 0.43
▸ AKR1C3 P42330 5/20 0.43
▸ AKR1C2 P52895 5/20 0.43
▸ PTGS1 P23219 2/20 0.43
▸ TAS2R14 Q9NYV8 1/20 0.43
▸ HSD17B10 Q99714 2/20 0.41
▸ WDR5 P61964 2/20 0.40
▸ LCK P06239 1/20 0.39
▸ FYN P06241 1/20 0.39
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA3 P07451 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ CA6 P23280 1/20 0.38
▸ CA5A P35218 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CA13 Q8N1Q1 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38

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
SCHEMBL16914511 0.78 CA1 (0.55) PTGS2HSD17B10LCKCA12CA1
SCHEMBL2348838 0.78 PTGS2 (0.44) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL26979278 0.78 AKR1C2 (0.44) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL21814272 0.77 KEAP1 (0.58) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL1633725 0.77 RXRB (0.46) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL15123097 0.77 ALDH1A1 (0.49) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL22628276 0.74 AKR1C2 (0.44) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL221445 0.74 KEAP1 (0.59) AKR1C3AKR1C2HSD17B10LCKFYN
SCHEMBL29377565 0.73 ALDH1A1 (0.53) PTGS2AKR1C3AKR1C2PTGS1TAS2R14
SCHEMBL1194182 0.73 ALDH1A1 (0.53) PTGS2AKR1C3AKR1C2PTGS1TAS2R14

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
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
EP-3796975-B1 SULFONYLAMINOBENZAMIDE DERIVATIVES ORSOBIO INC (US) 2023-08-30 — — EP disclosed
US-20220055985-A1 SULFINYLAMINOBENZAMIDE AND SULFONYLAMINOBENZAMIDE DERIVATIVES GILEAD SCIENCES, INC. 2022-02-24 — — US disclosed
US-11136290-B2 Sulfinylaminobenzamide and sulfonylaminobenzamide derivatives THE LIVER COMPANY INC. (US) 2021-10-05 — — US disclosed
EP-3796975-A1 SULFINYLAMINOBENZAMIDE AND SULFONYLAMINOBENZAMIDE DERIVATIVES GILEAD SCIENCES, INC. (US) 2021-03-31 — — EP 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 (2 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-20220055985-A1 SULFINYLAMINOBENZAMIDE AND SULFONYLAMINOBENZAMIDE DERIVATIVES STS, SULT2A1, SCN2B PTGS2 1558/4885AKR1C3 3403/4885AKR1C2 2364/4885
US-11136290-B2 Sulfinylaminobenzamide and sulfonylaminobenzamide derivatives STS, SULT2A1, SCN2B PTGS2 1558/4885AKR1C3 3403/4885AKR1C2 2364/4885

“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.

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