SCHEMBL642149

SCHEMBL642149

CS(=O)(=O)OC1CCCN(C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.34
EPHX2 P34913 1/20 0.34
GAA P10253 1/20 0.33
BTK Q06187 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HCRTR2 O43614 1/20 0.32
TSHR P16473 1/20 0.32
HPGD P15428 1/20 0.32
CYP2D6 P10635 1/20 0.31
HTT P42858 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL4744840 1.00 TAAR1 (0.34) TAAR1EPHX2GAABTKMAPK1
SCHEMBL5120488 1.00 TAAR1 (0.34) TAAR1EPHX2GAABTKMAPK1
SCHEMBL5667133 0.97 TAAR1 (0.36) TAAR1EPHX2GAABTKMAPK1
SCHEMBL9937310 0.95 DPP4 (0.33) TAAR1EPHX2BTKALDH1A1LMNA
SCHEMBL2679564 0.90 TP53 (0.32)
SCHEMBL1998545 0.90 TP53 (0.32)
SCHEMBL344785 0.90 TP53 (0.32)
SCHEMBL5991039 0.89 HRH3 (0.33) GAAMAPK1
SCHEMBL18825094 0.87 HRH3 (0.34) GAAMAPK1ALDH1A1HCRTR2TSHR
SCHEMBL20595095 0.87 CYP4A11 (0.39) GAAMAPK1ALDH1A1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3782996-B1 NRF2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-04-10 EP disclosed
US-20240051951-A1 BICYCLIC COMPOUND AND USE THEREOF SK BIOPHARMACEUTICALS CO., LTD. (KR) 2024-02-15 US disclosed
EP-4288426-A1 QUINOXALINE DERIVATIVES AND USES THEREOF Black Diamond Therapeutics, Inc. (US) 2023-12-13 EP disclosed
US-20230286965-A1 BICYCLIC COMPOUND AND USE THEREOF SK BIOPHARMACEUTICALS CO., LTD. (KR) 2023-09-14 US disclosed
US-11725001-B2 Bicyclic compound and use thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2023-08-15 US disclosed
US-20230219973-A1 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF MOLECURE S.A. (PL) 2023-07-13 US disclosed
US-20230212122-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-07-06 US disclosed
EP-4157263-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES The Regents Of The University Of Michigan (US) 2023-04-05 EP disclosed
US-20230047296-A1 Nrf2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-02-16 US disclosed
US-20220402902-A1 BICYCLIC COMPOUND AND USE THEREOF SK BIOPHARMACEUTICALS CO., LTD. 2022-12-22 US disclosed
EP-3120852-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR IMMUNE DISEASES Taiho Pharmaceutical Co., Ltd. (JP) 2017-01-25 EP disclosed
EP-3115365-A1 NOVEL SALT OF CONDENSED PYRIMIDINE COMPOUND, AND CRYSTALS THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2017-01-11 EP disclosed
US-20160324878-A1 PHARMACEUTICAL COMPOSITIONS AND THEIR USE FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASES Zhejiang DTRM Biopharma Co. Ltd. (CN) 2016-11-10 US disclosed
US-20140323464-A1 KINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-10-30 US disclosed
EP-2710007-A2 KINASE INHIBITORS The Regents of the University of California (US) 2014-03-26 EP disclosed
WO-2012158843-A2 KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-11-22 WO disclosed
US-8119805-B2 Substituted disulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-21 US disclosed
US-20100152158-A1 Substituted Disulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-06-17 US disclosed
EP-1963304-A1 ISOQUINOLINE DERIVATIVES N.V. Organon (NL) 2008-09-03 EP disclosed
WO-2007065916-A1 ISOQUINOLINE DERIVATIVES N.V. ORGANON (NL) 2007-06-14 WO 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 (10 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-20220402902-A1 BICYCLIC COMPOUND AND USE THEREOF PRMT5, PRMT6, PRMT1 TAAR1 4367/4885EPHX2 3328/4885GAA 3496/4885
US-20100152158-A1 Substituted Disulfonamide Compounds BDKRB1, BDKRB2, BRS3 TAAR1 51/4885EPHX2 3092/4885GAA 4666/4885
US-20140323464-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 TAAR1 4245/4885EPHX2 3369/4885GAA 2400/4885
US-20240051951-A1 BICYCLIC COMPOUND AND USE THEREOF PRMT5, PRMT6, PRMT1 TAAR1 4367/4885EPHX2 3328/4885GAA 3496/4885
US-20230286965-A1 BICYCLIC COMPOUND AND USE THEREOF PRMT5, PRMT6, PRMT8 TAAR1 4497/4885EPHX2 3518/4885GAA 3351/4885
US-20230219973-A1 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF USP7, USP28, USP1 TAAR1 4139/4885EPHX2 2191/4885GAA 192/4885
US-20230047296-A1 Nrf2 REGULATORS NFE2L2, KEAP1, NQO1 TAAR1 2709/4885EPHX2 996/4885GAA 2150/4885
US-11725001-B2 Bicyclic compound and use thereof PRMT5, PRMT6, PRMT1 TAAR1 4367/4885EPHX2 3328/4885GAA 3496/4885
US-20160324878-A1 PHARMACEUTICAL COMPOSITIONS AND THEIR USE FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASES BTK, BCL9, BCL9L TAAR1 4758/4885EPHX2 4189/4885GAA 1593/4885
US-20230212122-A1 MITOCHONDRIAL TARGETING COMPOUNDS FOR THE TREATMENT OF ASSOCIATED DISEASES TFAM, CS, FH TAAR1 3807/4885EPHX2 3263/4885GAA 323/4885

“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.