SCHEMBL2177341

SCHEMBL2177341

CN(CCOc1ccc(C=C2NC(=O)SC2=O)cc1)c1nc2ccccc2s1

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.81
CSNK2A2 P19784 1/20 0.46
CLK1 P49759 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK2 Q92630 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43
ATP4A P20648 5/20 0.43
ATP4B P51164 5/20 0.43
HDAC4 P56524 1/20 0.43
HDAC8 Q9BY41 1/20 0.43

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
SCHEMBL2177329 0.90 PPARG (1.00) PPARGHDAC4HDAC8
SCHEMBL2177332 0.90 PPARG (1.00) PPARGHDAC4HDAC8
SCHEMBL12520491 0.90 PPARG (1.00) PPARGHDAC4HDAC8
SCHEMBL1847314 0.85 PPARG (0.66) PPARG
SCHEMBL12521900 0.85 PPARG (0.91) PPARGHDAC4HDAC8
SCHEMBL1845215 0.83 PPARG (0.57) PPARGCSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL1851769 0.83 PPARG (0.56) PPARGCSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL2179894 0.83 PPARG (0.56) PPARGCSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL6801314 0.82 PPARG (0.70) PPARGATP4AATP4B
SCHEMBL1846171 0.81 PPARG (0.55) PPARGCSNK2A2CLK1CSNK2BCSNK2A1

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 28 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
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-20150073025-A1 METHOD FOR IDENTIFYING DISEASE RISK FACTORS ZINFANDEL PHARMACEUTICALS INC (US) 2015-03-12 US disclosed
US-20150073022-A1 DISEASE RISK FACTORS AND METHODS OF USE ZINFANDEL PHARMACEUTICALS, INC. (US) 2015-03-12 US disclosed
US-8846315-B2 Disease risk factors and methods of use ZINFANDEL PHARMACEUTICALS, INC. (US) 2014-09-30 US disclosed
US-5521201-A SUBSTITUTED-THIAZOLIDINEDIONE DERIVATIVES BEECHAM GROUP P.L.C. 1996-05-28 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 (3 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 PPARG 16/4885CSNK2A2 1766/4885CLK1 2863/4885
US-20020049240-A1 NOVEL COMPOUNDS GRK1, GRK3, GRK7 PPARG 715/4885CSNK2A2 989/4885CLK1 3123/4885
US-20150073022-A1 DISEASE RISK FACTORS AND METHODS OF USE TSG101, TOMM40, TOMM70 PPARG 1229/4885CSNK2A2 2953/4885CLK1 4641/4885

“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.