SCHEMBL1845874

SCHEMBL1845874

O=C1NC(Cc2ccc(OCCN(Cc3ccccc3)c3nc4ccccc4s3)cc2)C(=O)S1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 9/20 0.62
PPARG P37231 8/20 0.58
PPARA Q07869 1/20 0.54
HRH3 Q9Y5N1 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
KARS1 Q15046 1/20 0.36
ATP4A P20648 2/20 0.36
ATP4B P51164 2/20 0.36

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
SCHEMBL2180568 0.86 PPARG (0.70) PPARDPPARGPPARAATP4AATP4B
SCHEMBL1845872 0.83 PPARG (0.82) PPARDPPARGPPARA
SCHEMBL2178690 0.78 PPARG (0.80) PPARDPPARGPPARA
SCHEMBL1847312 0.78 PPARG (0.80) PPARDPPARGPPARA
SCHEMBL6804832 0.77 PPARD (0.70) PPARDPPARGPPARAATP4AATP4B
SCHEMBL1847314 0.77 PPARG (0.66) PPARDPPARGPPARA
SCHEMBL9326656 0.75 HRH3 (0.48) PPARGPPARAHRH3
SCHEMBL1849198 0.74 PPARG (0.49) PPARGPPARAHRH3ATP4AATP4B
SCHEMBL9311838 0.73 FFAR1 (0.43) PPARG
SCHEMBL12521697 0.73 PPARG (1.00) PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030149054-A1 Administering thiazolidinedione derivatives for therapy and prophylaxis of cardiovascular diseases or eating disorders in a human or non- human mammal BEECHAM GROUP P.L.C. 2003-08-07 US claimed
EP-1306086-A2 Use of thiazolidinediones for the treatment of atherosclerosis and eating disorders SMITHKLINE BEECHAM PLC (GB) 2003-05-02 EP claimed
US-20020049240-A1 NOVEL COMPOUNDS BEECHAM GROUP P.1.C. 2002-04-25 US claimed
US-5756525-A USING A THIAZOLIDINEDIONE COMPOUND BEECHAM GROUP PLC (GB) 1998-05-26 US claimed
EP-0842925-A1 Substituted thiazolidinedione derivatives BEECHAM GROUP PLC (GB) 1998-05-20 EP claimed
EP-0695183-A1 USE OF THIAZOLIDINEDIONES FOR THE TREATMENT OF ATHEROSCLEROSIS AND EATING DISORDERS SMITHKLINE BEECHAM PLC (GB) 1996-02-07 EP claimed
WO-1994025026-A1 USE OF THIAZOLIDINEDIONES FOR THE TREATMENT OF ATHEROSCLEROSIS AND EATING DISORDERS SMITHKLINE BEECHAM PLC (GB) 1994-11-10 WO claimed
US-5232925-A Treating hypertension BEECHAM GROUP P.L.C. (GB) 1993-08-03 US claimed
US-5002953-A Substituted Thiazolidinedione Derivatives BEECHAM GROUP P.L.C. (GB) 1991-03-26 US claimed
EP-0306228-A1 Substituted thiazolidinedione derivatives BEECHAM GROUP PLC (GB) 1989-03-08 EP claimed
US-11021751-B2 Disease risk factors and methods of use ZINFANDEL PHARMACEUTICALS, INC. (US) 2021-06-01 US disclosed
US-20210095345-A1 METHOD OF IDENTIFYING DISEASE RISK FACTORS ZINFANDEL PHARMACEUTICALS INC (US) 2021-04-01 US disclosed
US-10865449-B2 Method of identifying disease risk factors ZINFANDEL PHARMACEUTICALS, INC. (US) 2020-12-15 US disclosed
EP-2789695-B1 Anti-Alzheimer's disease treatment of subjects identified by detecting the presence of a genetic variant in the TOMM40 gene at rs 10524523 ZINFANDEL PHARMACEUTICALS INC (US) 2019-10-30 EP disclosed
US-20190032137-A1 DISEASE RISK FACTORS AND METHODS OF USE ZINFANDEL PHARMACEUTICALS, INC. (US) 2019-01-31 US disclosed
US-5260445-A Hypoglycemic BEECHAM GROUP P.L.C. (GB) 1993-11-09 US disclosed
US-5232925-A Treating hypertension BEECHAM GROUP P.L.C. (GB) 1993-08-03 US disclosed
US-5194443-A Thiazolinediones, Hypoglycemic Agents, Antilipemic Agents BEECHAM GROUP P.L.C. (GB) 1993-03-16 US disclosed
US-5002953-A Substituted Thiazolidinedione Derivatives BEECHAM GROUP P.L.C. (GB) 1991-03-26 US disclosed
EP-0306228-A1 Substituted thiazolidinedione derivatives BEECHAM GROUP PLC (GB) 1989-03-08 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 (2 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-20030149054-A1 Administering thiazolidinedione derivatives for therapy and prophylaxis of cardiovascular diseases or eating disorders in a human or non- human mammal TYK2, FABP3, FABP4 PPARD 4/4885PPARG 16/4885PPARA 20/4885
US-20020049240-A1 NOVEL COMPOUNDS GRK1, GRK3, GRK7 PPARD 2170/4885PPARG 715/4885PPARA 2154/4885

“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.