SCHEMBL1134428

SCHEMBL1134428

CN(C)c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
ALOX15 P16050 3/20 0.55
HSD17B10 Q99714 2/20 0.55
HPGD P15428 2/20 0.55
KDM4E B2RXH2 1/20 0.55
TSHR P16473 4/20 0.52
LMNA P02545 2/20 0.52
NSD2 O96028 1/20 0.51
CA9 Q16790 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
NT5E P21589 1/20 0.50
CA1 P00915 2/20 0.48
CA4 P22748 1/20 0.48
MAPT P10636 2/20 0.48

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
SCHEMBL27333040 0.98 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDKDM4E
Hydrochloric Acid SCHEMBL28095718 0.98 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDKDM4E
SCHEMBL28203165 0.94 ALDH1A1 (0.50) ALDH1A1ALOX15HSD17B10HPGDKDM4E
SCHEMBL18900607 0.88 ALDH1A1 (0.51) ALDH1A1ALOX15HSD17B10HPGDKDM4E
Methyl Orange SCHEMBL16163325 0.88 NPC1 (0.69) ALDH1A1ALOX15HSD17B10HPGDKDM4E
Methyl Orange SCHEMBL296471 0.88 NPC1 (0.69) ALDH1A1ALOX15HSD17B10HPGDKDM4E
SCHEMBL16667874 0.88 CA2 (0.51) ALDH1A1ALOX15HSD17B10HPGDKDM4E
Methyl Orange SCHEMBL296472 0.88 NPC1 (0.69) ALDH1A1ALOX15HSD17B10HPGDKDM4E
Methyl Orange SCHEMBL19662 0.87 NPC1 (0.67) ALDH1A1ALOX15HSD17B10HPGDKDM4E
SCHEMBL11594922 0.87 TSHR (0.53) ALDH1A1ALOX15HSD17B10HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116103711-A Forward and reverse pulse electrolytic nickel-phosphorus alloy solution, preparation method, electroplating method and nickel-phosphorus alloy coating 安徽智备工业科技有限公司 2023-05-12 CN claimed
CN-112881311-A Creatine kinase detection reagent, kit and detection method 深圳迈瑞生物医疗电子股份有限公司 2021-06-01 CN claimed
WO-2012168458-A1 ZWITTERIONIC COMPOUNDS USEFUL AS CATALYSTS FOR ESTERIFICATION REACTIONS AND PROCESSES FOR THEIR PRODUCTION ECOSYNTH BVBA (BE) 2012-12-13 WO claimed
CN-120944201-A Insole rubber composite modified material and preparation method thereof 广东乐骏新材料有限公司 2025-11-14 CN disclosed
US-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
CN-116103711-A Forward and reverse pulse electrolytic nickel-phosphorus alloy solution, preparation method, electroplating method and nickel-phosphorus alloy coating 安徽智备工业科技有限公司 2023-05-12 CN disclosed
CN-112694880-B Surfactant composition containing aniline compound for oil displacement, and preparation method and application thereof 中国石油化工股份有限公司 2023-05-02 CN disclosed
CN-115160301-A Diphyllin derivative, preparation method and application thereof 上海交通大学 2022-10-11 CN disclosed
CN-110317137-B 9, 10-anthraquinone compound or pharmaceutically acceptable salt thereof and pharmaceutical application thereof 复旦大学 2022-04-19 CN disclosed
CN-111362829-B Minocycline di-p-chlorobenzenesulfonate crystal form and preparation method and application thereof 浙江昌海制药有限公司 2021-11-30 CN disclosed
EP-0254950-A2 (Meth-)acrylic esters BAYER AG (DE) 1988-02-03 EP disclosed
EP-0254263-A2 (Meth)acrylic acid derivatives containing urethane groups BAYER AG (DE) 1988-01-27 EP disclosed
EP-0254185-A1 (Meth)acrylic acid derivatives of tricyclo[5.2.1.02.6]decanes containing urethane groups BAYER AG (DE) 1988-01-27 EP disclosed
US-4698445-A ANTIARRHYTHMIA AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1987-10-06 US disclosed
US-4692548-A DIMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS SHELL OIL COMPANY (US) 1987-09-08 US disclosed
EP-0206367-A2 Process for the dimerization of ethylenically unsaturated compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-12-30 EP disclosed
EP-0188830-A1 Process for the preparation of dimerization products from olefins SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1986-07-30 EP disclosed
US-4599476-A PALLADIUM OR RUTHENIUM CATALYST SHELL OIL COMPANY (US) 1986-07-08 US disclosed
CN-85109193-A With alkene is the method for feedstock production dimerisation products 1986-06-10 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 (1 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-11718641-B2 Bile acid derivatives as FXR/TGR5 agonists and methods of use thereof GPBAR1, NR1H4, SLC10A1 ALDH1A1 2372/4885ALOX15 454/4885HSD17B10 239/4885

“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.