SCHEMBL2177332

SCHEMBL2177332

CN(CCOc1ccc(C=C2SC(=O)NC2=O)cc1)c1nc2ccccc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 1.00
PIM1 P11309 2/20 0.54
PIM2 Q9P1W9 2/20 0.54
HDAC4 P56524 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HPGD P15428 4/20 0.53
PTPN11 Q06124 1/20 0.51
CISD1 Q9NZ45 1/20 0.50

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 1.00 PPARG (1.00) PPARGPIM1PIM2HDAC4HDAC8
SCHEMBL12520491 1.00 PPARG (1.00) PPARGPIM1PIM2HDAC4HDAC8
SCHEMBL12521900 0.95 PPARG (0.91) PPARGPIM1PIM2HDAC4HDAC8
SCHEMBL2177341 0.90 PPARG (0.81) PPARGHDAC4HDAC8
SCHEMBL12521729 0.89 PPARG (1.00) PPARGPIM1PIM2HDAC4HDAC8
SCHEMBL12521723 0.88 PPARG (0.78) PPARGPIM1PIM2HDAC4HDAC8
SCHEMBL2178690 0.85 PPARG (0.80) PPARGHPGD
SCHEMBL1847312 0.85 PPARG (0.80) PPARGHPGD
SCHEMBL1845213 0.83 PPARG (0.71) PPARGPIM1PIM2HPGDCISD1
SCHEMBL12520388 0.83 PPARG (0.71) PPARGPIM1PIM2HPGDCISD1

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 30 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
JP-10194970-A None JP disclosed
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-20150073022-A1 DISEASE RISK FACTORS AND METHODS OF USE ZINFANDEL PHARMACEUTICALS, INC. (US) 2015-03-12 US disclosed
US-20150073025-A1 METHOD FOR IDENTIFYING DISEASE RISK FACTORS ZINFANDEL PHARMACEUTICALS INC (US) 2015-03-12 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 16/4885PIM1 3064/4885PIM2 3068/4885
US-20020049240-A1 NOVEL COMPOUNDS GRK1, GRK3, GRK7 PPARG 715/4885PIM1 4286/4885PIM2 4673/4885
US-20150073022-A1 DISEASE RISK FACTORS AND METHODS OF USE TSG101, TOMM40, TOMM70 PPARG 1229/4885PIM1 3384/4885PIM2 3542/4885

“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.