SCHEMBL6132278

SCHEMBL6132278

CS(=O)(=O)O[C@H]1CC[C@H](C)CC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
HCRTR2 O43614 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL5639385 1.00 CA1 (0.34) CA1CA2HCRTR2KDM4EALDH1A1
SCHEMBL6135269 1.00 CA1 (0.34) CA1CA2HCRTR2KDM4EALDH1A1
SCHEMBL4334769 0.89 CA1 (0.40) CA1CA2ALDH1A1USP2TSHR
SCHEMBL2099337 0.89
SCHEMBL18604421 0.87
SCHEMBL2589380 0.86 CYP19A1 (0.33)
SCHEMBL25937220 0.86 CYP19A1 (0.33)
SCHEMBL1606337 0.82 CA1 (0.36) CA1CA2
SCHEMBL30055490 0.82 CA1 (0.36) CA1CA2USP2TSHRHRH3
SCHEMBL24511672 0.80 CA1 (0.34) CA1CA2USP2TSHRHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12448377-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-10-21 US disclosed
EP-4066893-B1 6,7,8,9-TETRAHYDRO-4H-QUINOLIZIN-4-ONE COMPOUND AS OREXIN TYPE 2 RECEPTOR AGONIST TAKEDA PHARMACEUTICALS CO (JP) 2025-07-30 EP disclosed
US-11667602-B2 Compounds and their use ASTRAZENECA AB (SE) 2023-06-06 US disclosed
US-20230037557-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-09 US disclosed
EP-4066893-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2022-10-05 EP disclosed
EP-2879673-B1 1,5,6-substituted naphthalene derivatives as sphingosine 1 phosphate (S1P) receptor and/or autotaxin (ATX) modulators for treating inflammatory and autoimmune disorders BIOGEN MA INC (US) 2018-07-25 EP disclosed
US-10017506-B2 ATX modulating agents BIOGEN MA INC. (US) 2018-07-10 US disclosed
US-10017506-B2 ATX modulating agents BIOGEN MA INC. (US) 2018-07-10 US disclosed
EP-2877185-B1 2-(1-(1-(6-((CYCLOHEXYL)OXY)-5-(TRIFLUOROMETHYL)NAPHTHALEN-2-YL)ETHYL)PIPERIDIN-3-YL)ACETIC ACID DERIVATIVES AS AUTOTAXIN (ATX) MODULATORS FOR THE TREATMENT OF INFLAMMATIONS AND AUTOIMMUNE DISORDERS BIOGEN MA INC (US) 2018-05-23 EP disclosed
US-9944666-B2 Compounds that are S1P modulating agents and/or ATX modulating agents BIOGEN MA INC. (US) 2018-04-17 US disclosed
US-20110065928-A1 Process for Preparing Azabicyclic Compounds VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-17 US disclosed
WO-2010015524-A1 METHOD FOR STEREOSELECTIVE SYNTHESIS OF BICYCLIC HETEROCYCLENE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-02-11 WO disclosed
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
US-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 US disclosed
EP-1259535-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-27 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 WO disclosed
WO-2001060846-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 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 (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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 CA1 2356/4885CA2 1899/4885HCRTR2 4377/4885
US-11667602-B2 Compounds and their use RXFP1, RXFP3, RXFP2 CA1 2968/4885CA2 3263/4885HCRTR2 2280/4885
US-12448377-B2 Heterocyclic compound HCRTR2, HCRTR1, NTSR2 CA1 1114/4885CA2 600/4885HCRTR2 1/4885
US-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 CA1 1819/4885CA2 1760/4885HCRTR2 4292/4885
US-20110065928-A1 Process for Preparing Azabicyclic Compounds AZI2, DHPS, PAICS CA1 1907/4885CA2 3276/4885HCRTR2 4809/4885
US-10017506-B2 ATX modulating agents ENPP2, ATXN10, ATXN2 CA1 2758/4885CA2 3904/4885HCRTR2 2800/4885
US-20230037557-A1 HETEROCYCLIC COMPOUND HCRTR2, HCRTR1, NTSR2 CA1 1114/4885CA2 600/4885HCRTR2 1/4885

“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.