SCHEMBL2111043

SCHEMBL2111043

COc1cc(C)cc(NCCCS(=O)(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SLC2A1 P11166 1/20 0.37
ALDH1A1 P00352 4/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 2/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
F2 P00734 1/20 0.35
PKM P14618 1/20 0.35
KEAP1 Q14145 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
SCHEMBL244918 0.91 KMT2A (0.42) MTNR1AMTNR1BKMT2ALMNASMN1; SMN2
SCHEMBL27677191 0.90 KMT2A (0.41) MTNR1AMTNR1BKMT2ALMNASMN1; SMN2
Water SCHEMBL20853621 0.88 KMT2A (0.41) MTNR1AMTNR1BKMT2ALMNASMN1; SMN2
SCHEMBL5587045 0.88 KMT2A (0.42) MTNR1AMTNR1BKMT2ALMNASMN1; SMN2
SCHEMBL1823998 0.86 THRB (0.44) SMN1; SMN2HTTALDH1A1MAPT
SCHEMBL5586997 0.83 THRB (0.44) KMT2AHTTALDH1A1MAPT
SCHEMBL28590884 0.82 THRB (0.43) KMT2AHTTALDH1A1MAPT
SCHEMBL28604711 0.82 THRB (0.43) KMT2AHTTALDH1A1MAPT
SCHEMBL2498356 0.81 MTNR1A (0.59) MTNR1AMTNR1BKMT2ALMNASMN1; SMN2
SCHEMBL917492 0.79 GAA (0.59) KMT2ASMN1; SMN2MEN1SLC2A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011124-A GLP-1R/GIPR/GCGR triple receptor agonist and application thereof 上海生物制品研究所有限责任公司 2026-05-12 CN disclosed
CN-122011123-A GLP-1R/GIPR/GCGR triple receptor agonist and application thereof 上海生物制品研究所有限责任公司 2026-05-12 CN disclosed
US-20260125737-A1 REAGENT COMPOSITION AND KIT DENKA COMPANY LIMITED (JP) 2026-05-07 US disclosed
EP-4328320-B1 REAGENT COMPOSITION AND KIT DENKA COMPANY LTD (JP) 2026-04-29 EP disclosed
US-20260076918-A1 HETEROTELECHELIC COMPOUNDS KAWASAKI INSTITUTE OF INDUSTRIAL PROMOTION (JP) 2026-03-19 US disclosed
US-20250388544-A1 HETEROAROMATIC INHIBITORS OF ASTACIN PROTEINASES VIVORYON THERAPEUTICS N.V. (DE) 2025-12-25 US disclosed
WO-2025224169-A1 DOSE REGIMENS FOR THE GLUTAMINYL CYCLASE INHIBITOR VAROGLUTAMSTAT VIVORYON THERAPEUTICS N.V. (DE) 2025-10-30 WO disclosed
WO-2025224179-A1 GLUTAMINYL CYCLASE INHBITORS FOR USE IN THE TREATMENT OF KIDNEY DISEASE VIVORYON THERAPEUTICS N.V. (DE) 2025-10-30 WO disclosed
US-20250327111-A1 REAGENT COMPOSITION AND KIT DENKA COMPANY LIMITED (JP) 2025-10-23 US disclosed
US-12378186-B2 Inhibitors of meprin α and β VIVORYON THERAPEUTICS N.V. (DE) 2025-08-05 US disclosed
US-20220299535-A1 METHOD AND KIT FOR QUANTIFICATION OF SMALL, DENSE LDL CHOLESTEROL DENKA COMPANY LIMITED (JP) 2022-09-22 US disclosed
EP-4029949-A1 KIT AND METHOD Denka Company Limited (JP) 2022-07-20 EP disclosed
EP-4029948-A1 METHOD AND KIT FOR QUANTIFYING SMALL, DENSE LDL CHOLESTEROL Denka Company Limited (JP) 2022-07-20 EP disclosed
CN-114544924-A Application of glyceride in disease prediction 中国科学院上海营养与健康研究所 2022-05-27 CN disclosed
EP-3986868-A1 HETEROAROMATIC INHIBITORS OF ASTACIN PROTEINASES Vivoryon Therapeutics N.V. (DE) 2022-04-27 EP disclosed
CN-114364810-A Method and kit for quantifying small, dense LDL cholesterol 电化株式会社 2022-04-15 CN disclosed
CN-114364809-A Kits and methods 电化株式会社 2022-04-15 CN disclosed
EP-3967679-A1 NOVEL INHIBITORS OF MEPRIN ALPHA AND BETA Vivoryon Therapeutics AG (DE) 2022-03-16 EP disclosed
US-8158375-B2 Polymer and method of measuring cholesterol therewith WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-04-17 US disclosed
US-20090215097-A1 Novel Polymer and Method of Measuring Cholesterol Therewith WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2009-08-27 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 (4 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-20260076918-A1 HETEROTELECHELIC COMPOUNDS LDLR, MSR1, LPAR2 MTNR1A 207/4885MTNR1B 411/4885KMT2A 2449/4885
US-20250388544-A1 HETEROAROMATIC INHIBITORS OF ASTACIN PROTEINASES BMP1, BMPR1A, BMPR1B MTNR1A 498/4885MTNR1B 491/4885KMT2A 4184/4885
US-20260125737-A1 REAGENT COMPOSITION AND KIT LIPA, LIPC, CETP MTNR1A 4757/4885MTNR1B 4732/4885KMT2A 2659/4885
US-12378186-B2 Inhibitors of meprin α and β MEP1A, MEP1B, CAPRIN1 MTNR1A 2780/4885MTNR1B 2725/4885KMT2A 3359/4885

“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.