SCHEMBL780280

SCHEMBL780280

CC(C)(C)S(=O)(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.60
HTR6 P50406 5/20 0.50
PSIP1 O75475 1/20 0.48
ALOX15 P16050 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CA12 O43570 1/20 0.46
CA3 P07451 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
PLA2G7 Q13093 1/20 0.46
CA9 Q16790 1/20 0.46
CA13 Q8N1Q1 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46

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
Fluoride SCHEMBL775526 0.97 ALDH1A1 (0.58) ALDH1A1HTR6PSIP1ALOX15L3MBTL1
SCHEMBL2702059 0.86 ALDH1A1 (0.57) ALDH1A1CA1CA2CA12CA9
SCHEMBL16469554 0.85 HTR6 (0.46) ALDH1A1HTR6PSIP1ALOX15L3MBTL1
SCHEMBL6544675 0.84 HTR6 (0.50) ALDH1A1HTR6PSIP1CA1CA2
SCHEMBL384939 0.84 HTR6 (0.50) ALDH1A1HTR6PSIP1CA1CA2
SCHEMBL19033894 0.82 HTR6 (0.48) ALDH1A1HTR6PSIP1CA1CA2
SCHEMBL7296391 0.81 PSIP1 (0.46) ALDH1A1HTR6PSIP1ALOX15CA1
SCHEMBL9412343 0.81 HTR6 (0.42) ALDH1A1HTR6PSIP1ALOX15CA1
SCHEMBL12895710 0.81 SOS1 (0.58) ALDH1A1CA1CA2CA9TSHR
SCHEMBL2705476 0.81 PTGES2 (0.46) ALDH1A1HTR6ALOX15CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113707933-A Preparation method of solid electrolyte nano dispersion liquid of lithium ion battery and solid electrolyte nano dispersion liquid 北京卫蓝新能源科技有限公司 2021-11-26 CN claimed
US-6495336-B1 OLIGOPEPTIDE DERIVATIVES WHOSE C-TERMINAL AMINO ACID IS ARGININE WHICH IS LINKED TO THE REMAINDER OF AN ELECTROACTIVE ANILINE OR AMINOQUINILONE; SUBSTRATE FOR QUANTITATIVELY DETERMINING ENZYMES, ESPECIALLY THROMBIN, IN BLOOD PENTAPHARM AG (CH) 2002-12-17 US claimed
US-20250188046-A1 ULTRAFAST FLOW SYNTHESIS OF FUNCTIONALIZED SULFONYL FLUORIDES AND SUBSEQUENT SUFEX CONNECTIONS VIA LITHIATED CHEMISTRY POSTECH Research and Business Development Foundation (KR) 2025-06-12 US disclosed
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-12016896-B2 Dipeptidomimetics as inhibitors of human immunoproteasomes CORNELL UNIVERSITY (US) 2024-06-25 US disclosed
US-12016896-B2 Dipeptidomimetics as inhibitors of human immunoproteasomes CORNELL UNIVERSITY (US) 2024-06-25 US disclosed
US-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease SHY Therapeutics LLC 2023-09-14 US disclosed
US-20230278958-A1 TRICYCLIC HETEROCYCLES MERCK PATENT GMBH (DE) 2023-09-07 US disclosed
US-11724998-B2 PXR agonists and uses thereof for gut barrier dysfunction treatment and prevention ALBERT EINSTEIN COLLEGE OF MEDICINE (US) 2023-08-15 US disclosed
US-20230212195-A1 COMPOUNDS, CONJUGATES, AND COMPOSITIONS OF EPIPOLYTHIODIKETOPIPERAZINES AND POLYTHIODIKETOPIPERAZINES AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-07-06 US disclosed
US-20230174538-A1 Tricyclic heterocycles MERCK PATENT GMBH (DE) 2023-06-08 US disclosed
US-20050239994-A1 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2005-10-27 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
US-6495336-B1 OLIGOPEPTIDE DERIVATIVES WHOSE C-TERMINAL AMINO ACID IS ARGININE WHICH IS LINKED TO THE REMAINDER OF AN ELECTROACTIVE ANILINE OR AMINOQUINILONE; SUBSTRATE FOR QUANTITATIVELY DETERMINING ENZYMES, ESPECIALLY THROMBIN, IN BLOOD PENTAPHARM AG (CH) 2002-12-17 US disclosed
EP-1157029-A1 OLIGOPEPTIDE DERIVATIVES FOR THE ELECTROCHEMICAL MEASUREMENT OF PROTEASE ACTIVITY Pentapharm AG (CH) 2001-11-28 EP disclosed
WO-2000050446-A1 OLIGOPEPTIDE DERIVATIVES FOR THE ELECTROCHEMICAL MEASUREMENT OF PROTEASE ACTIVITY PENTAPHARM AG (CH) 2000-08-31 WO disclosed
EP-0409412-B1 Diaryl ether cyclic ethers ICI PLC (GB) 1994-07-20 EP disclosed
EP-0409412-A2 Diaryl ether cyclic ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-23 EP disclosed
US-4166866-A Immunosuppressive method with dithiocarbamates THE CALIFORNIA POLYTECHNIC STATE UNIVERSITY FOUNDATION (US) 1979-09-04 US disclosed
US-4130578-A Immunosuppressive dithiocarbanilates THE UPJOHN COMPANY (US) 1978-12-19 US 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 (7 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-20230212195-A1 COMPOUNDS, CONJUGATES, AND COMPOSITIONS OF EPIPOLYTHIODIKETOPIPERAZINES AND POLYTHIODIKETOPIPERAZINES AND USES THEREOF DNPEP, DHPS, NPEPPS ALDH1A1 2862/4885HTR6 1438/4885PSIP1 950/4885
US-20250188046-A1 ULTRAFAST FLOW SYNTHESIS OF FUNCTIONALIZED SULFONYL FLUORIDES AND SUBSEQUENT SUFEX CONNECTIONS VIA LITHIATED CHEMISTRY FGFR4, STS, FGFR1 ALDH1A1 1626/4885HTR6 3280/4885PSIP1 196/4885
US-20230278958-A1 TRICYCLIC HETEROCYCLES YAP1, TERF2IP, TEAD1 ALDH1A1 3813/4885HTR6 4554/4885PSIP1 2985/4885
US-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885HTR6 3456/4885PSIP1 3389/4885
US-20230174538-A1 Tricyclic heterocycles YAP1, TEAD1, TERF2IP ALDH1A1 3857/4885HTR6 4497/4885PSIP1 2941/4885
US-11724998-B2 PXR agonists and uses thereof for gut barrier dysfunction treatment and prevention NR1H2, NR1H4, NR1H3 ALDH1A1 3347/4885HTR6 1008/4885PSIP1 2859/4885
US-12016896-B2 Dipeptidomimetics as inhibitors of human immunoproteasomes PREP, CTSC, DNPEP ALDH1A1 3234/4885HTR6 2494/4885PSIP1 2136/4885

“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.