SCHEMBL187413

SCHEMBL187413

CCCCCS(=O)(=O)Cl.Cc1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MCHR1 Q99705 1/20 0.46
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
ALB P02768 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 2/20 0.41
G6PD P11413 1/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
ATM Q13315 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39

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
Hexane SCHEMBL11658743 0.91 MCHR1 (0.53) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL28238066 0.84 MCHR1 (0.47) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL1586 0.79 GAA (0.62) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL31231738 0.79 GAA (0.62) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL8778830 0.78 ALDH1A1 (0.77) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL7740987 0.77 GAA (0.50) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
Methylene Chloride SCHEMBL7156245 0.77 GAA (0.54) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL3976090 0.77 ALDH1A1 (0.44) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
SCHEMBL6621808 0.77 GAA (0.59) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2
Water SCHEMBL6162445 0.77 GAA (0.59) ALDH1A1CYP2C9CYP2C19CYP3A4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036203-B2 Methods of treating or reducing the risk of cardiovascular events and related diseases using SGLT-2 inhibitors MERCK SHARP & DOHME LLC (US) 2024-07-16 US disclosed
EP-3735975-A1 METHODS OF TREATING OR REDUCING THE RISK OF CARDIOVASCULAR EVENTS AND RELATED DISEASES USING SGLT-2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-11-11 EP disclosed
US-20200297692-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE MERCK SHARP & DOHME CORP. (US) 2020-09-24 US disclosed
US-10709684-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease MERCK SHARP & DOHME CORP. (US) 2020-07-14 US disclosed
US-20200054598-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE MERCK SHARP & DOHME CORP. (US) 2020-02-20 US disclosed
US-20200038368-A1 METHODS OF TREATING OR REDUCING THE RISK OF CARDIOVASCULAR EVENTS AND RELTED DISEASES USING SGLT-2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-02-06 US disclosed
US-10500186-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease MERCK SHARP & DOHME CORP. (US) 2019-12-10 US disclosed
US-20190142793-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE MERCK SHARP & DOHME CORP. (US) 2019-05-16 US disclosed
US-10285973-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease MERCK SHARP & DOHME CORP. (US) 2019-05-14 US disclosed
US-20190076395-A1 METHODS OF TREATING OR REDUCING THE RISK OF CARDIOVASCULAR EVENTS AND RELATED DISEASES USING SGLT-2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2019-03-14 US disclosed
US-20130225487-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER INC. (US) 2013-08-29 US disclosed
EP-2496583-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES Pfizer Inc. (US) 2012-09-12 EP disclosed
EP-2334687-B9 DIOXA-BICYCLO[3.2.1.]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER (US) 2012-08-08 EP disclosed
US-20120184486-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER INC. 2012-07-19 US disclosed
EP-2334687-B1 DIOXA-BICYCLO[3.2.1.]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER (US) 2012-01-04 EP disclosed
US-8080580-B2 Dioxa-bicyclo[3.2.1]octane-2,3,4-triol derivatives PFIZER INC. (US) 2011-12-20 US disclosed
EP-2334687-A1 DIOXA-BICYCLO[3.2.1.]OCTANE-2,3,4-TRIOL DERIVATIVES Pfizer Inc. (US) 2011-06-22 EP disclosed
WO-2011051864-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER INC. (US) 2011-05-05 WO disclosed
WO-2010023594-A1 DIOXA-BICYCLO[3.2.1.]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER INC. (US) 2010-03-04 WO disclosed
US-20100056618-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES PFIZER INC 2010-03-04 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 (12 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-20100056618-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES SLC5A2, SLC5A1, SLC2A2 ALDH1A1 993/4885CYP2C9 803/4885CYP2C19 1388/4885
US-10285973-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease SLC5A1, SLC5A2, SLC2A1 ALDH1A1 875/4885CYP2C9 1855/4885CYP2C19 2465/4885
US-10500186-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease SLC5A1, SLC5A2, SLC2A1 ALDH1A1 875/4885CYP2C9 1855/4885CYP2C19 2465/4885
US-20200297692-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE SLC5A1, SLC5A2, SLC2A1 ALDH1A1 875/4885CYP2C9 1855/4885CYP2C19 2465/4885
US-20200054598-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE SLC5A1, SLC5A2, SLC2A1 ALDH1A1 875/4885CYP2C9 1855/4885CYP2C19 2465/4885
US-20200038368-A1 METHODS OF TREATING OR REDUCING THE RISK OF CARDIOVASCULAR EVENTS AND RELTED DISEASES USING SGLT-2 INHIBITORS SLC5A1, SLC5A2, SLC2A1 ALDH1A1 523/4885CYP2C9 2602/4885CYP2C19 3301/4885
US-10709684-B2 SGLT-2 inhibitors for treating metabolic disorders in patients with renal impairment or chronic kidney disease SLC5A1, SLC5A2, SLC2A1 ALDH1A1 875/4885CYP2C9 1855/4885CYP2C19 2465/4885
US-20120184486-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES SLC5A2, SLC5A1, SLC2A2 ALDH1A1 1191/4885CYP2C9 703/4885CYP2C19 1200/4885
US-20130225487-A1 DIOXA-BICYCLO[3.2.1]OCTANE-2,3,4-TRIOL DERIVATIVES SLC5A2, SLC5A1, SLC2A2 ALDH1A1 1191/4885CYP2C9 703/4885CYP2C19 1200/4885
US-20190142793-A1 SGLT-2 INHIBITORS FOR TREATING METABOLIC DISORDERS IN PATIENTS WITH RENAL IMPAIRMENT OR CHRONIC KIDNEY DISEASE SLC5A1, SLC5A2, SLC2A1 ALDH1A1 847/4885CYP2C9 1848/4885CYP2C19 2458/4885
US-20190076395-A1 METHODS OF TREATING OR REDUCING THE RISK OF CARDIOVASCULAR EVENTS AND RELATED DISEASES USING SGLT-2 INHIBITORS SLC5A1, SLC5A2, GLP1R ALDH1A1 641/4885CYP2C9 2007/4885CYP2C19 2276/4885
US-12036203-B2 Methods of treating or reducing the risk of cardiovascular events and related diseases using SGLT-2 inhibitors SLC5A1, SLC5A2, GLP1R ALDH1A1 641/4885CYP2C9 2007/4885CYP2C19 2276/4885

“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.