SCHEMBL3349385

SCHEMBL3349385

CC1CC(=O)c2ccsc2S1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.42
KLK7 P49862 1/20 0.42
CES1 P23141 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
HTR2C P28335 2/20 0.33
GSK3B P49841 1/20 0.31
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 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
SCHEMBL1122649 1.00 KDM4E (0.44) KDM4EALDH1A1HPGDKLK7CES1
SCHEMBL1123239 1.00 KDM4E (0.44) KDM4EALDH1A1HPGDKLK7CES1
SCHEMBL8473555 0.78 S100A4 (0.35) ALDH1A1HPGDCES1HTR2CHTT
SCHEMBL9740397 0.75 HTR2C (0.32) HTR2C
SCHEMBL8793891 0.73 KMT2A (0.31) KMT2A
SCHEMBL9522438 0.71 GSK3B (0.43) KDM4EALDH1A1HPGDGSK3BKMT2A
SCHEMBL8794212 0.70 HTT (0.32) KDM4EALDH1A1HTR2CHTT
SCHEMBL3927087 0.70 HTR2C (0.34) KDM4EALDH1A1HTR2C
SCHEMBL15606100 0.69 HTR2C (0.39) KDM4EALDH1A1HPGDCES1HTR2C
SCHEMBL16886968 0.69 HTR2C (0.39) KDM4EALDH1A1HPGDCES1HTR2C

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010061398-A1 PROCESS FOR PREPARING DORZOLAMIDE HYDROCHLORIDE AND ITS INTERMEDIATE SUVEN LIFE SCIENCES LIMITED (IN) 2010-06-03 WO claimed
EP-2128161-A1 Process for obtaining 4-hydroxy-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-7,7-dioxide and its enantiomers, and applications thereof Ragactives, S.L. (ES) 2009-12-02 EP claimed
US-8263787-B2 Process for preparing dorzolamide CIPLA LIMITED (IN) 2012-09-11 US disclosed
US-8263787-B2 Process for preparing dorzolamide CIPLA LIMITED (IN) 2012-09-11 US disclosed
WO-2011101704-A1 PROCESS FOR PREPARING (4S, 6S)-4-(ETHYLAMINO)-5,6-DIHYDRO-6-METHYL-4H-THIENO-[2,3-B]THIOPYRAN-2-SULFONAMIDE-7,7-DIOXIDE AND ITS INTERMEDIATES MICRO LABS LIMITED (IN) 2011-08-25 WO disclosed
WO-2010061398-A1 PROCESS FOR PREPARING DORZOLAMIDE HYDROCHLORIDE AND ITS INTERMEDIATE SUVEN LIFE SCIENCES LIMITED (IN) 2010-06-03 WO disclosed
WO-2010061398-A1 PROCESS FOR PREPARING DORZOLAMIDE HYDROCHLORIDE AND ITS INTERMEDIATE SUVEN LIFE SCIENCES LIMITED (IN) 2010-06-03 WO disclosed
US-20100113804-A1 Process for Preparing Dorzolamide CIPLA LIMITED (IN) 2010-05-06 US disclosed
US-20100113804-A1 Process for Preparing Dorzolamide CIPLA LIMITED (IN) 2010-05-06 US disclosed
WO-2009144263-A2 PROCESS FOR OBTAINING 4-HYDROXY-6-METHYL-5, 6-DIHYDRO-4H-THIENO [2,3-b] THIOPYRAN-7, 7-DIOXIDE AND ITS ENANTIOMERS, AND APPLICATIONS THEREOF RAGACTIVES, S.L.U. (ES) 2009-12-03 WO disclosed
EP-2128161-A1 Process for obtaining 4-hydroxy-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-7,7-dioxide and its enantiomers, and applications thereof Ragactives, S.L. (ES) 2009-12-02 EP disclosed
EP-2128161-A1 Process for obtaining 4-hydroxy-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-7,7-dioxide and its enantiomers, and applications thereof Ragactives, S.L. (ES) 2009-12-02 EP disclosed
WO-2008135770-A2 PROCESS FOR PREPARING DORZOLAM IDE CIPLA LIMITED (IN) 2008-11-13 WO disclosed
EP-0296879-B1 SUBSTITUTED AROMATIC SULFONAMIDES AS ANTIGLAUCOMA AGENTS MERCK & CO. INC. (US) 1993-03-17 EP disclosed
US-4863922-A Substituted aromatic sulfonamides as antiglaucoma agents, compositions and use MERCK & CO., INC. (US) 1989-09-05 US disclosed
EP-0296879-A1 Substituted aromatic sulfonamides as antiglaucoma agents MERCK & CO. INC. (US) 1988-12-28 EP 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-20100113804-A1 Process for Preparing Dorzolamide SQOR, PPOX, DAO KDM4E 2357/4885ALDH1A1 275/4885HPGD 326/4885

“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.