SCHEMBL4200323

SCHEMBL4200323

O=C1NC(=O)/C(=C/c2ccc(-c3ccccc3)o2)S1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 11/20 1.00
PIK3CA P42336 5/20 0.76
IGF1R P08069 4/20 0.76
RXRA P19793 2/20 0.73
INSR P06213 2/20 0.73
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
POLB P06746 1/20 0.69
CDK2 P24941 1/20 0.69
AHR P35869 1/20 0.69
PIK3CB P42338 1/20 0.68
CASP3 P42574 1/20 0.67
BLM P54132 1/20 0.67
SENP8 Q96LD8 1/20 0.67
SENP7 Q9BQF6 1/20 0.67
SENP6 Q9GZR1 1/20 0.67
TDP1 Q9NUW8 1/20 0.67

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
SCHEMBL1064036 1.00 PIK3CG (1.00) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL1064039 1.00 PIK3CG (1.00) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL1082136 0.97 PIK3CG (0.95) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL1082135 0.97 PIK3CG (0.95) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL3125785 0.87 PIK3CG (0.78) PIK3CGPIK3CAIGF1RINSRMEN1
SCHEMBL3366587 0.87 PIK3CG (0.78) PIK3CGPIK3CAIGF1RINSRMEN1
SCHEMBL3125789 0.87 PIK3CG (0.78) PIK3CGPIK3CAIGF1RINSRMEN1
SCHEMBL3128780 0.86 PIK3CG (0.76) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL12004076 0.86 PIK3CG (0.76) PIK3CGPIK3CAIGF1RRXRAINSR
SCHEMBL3128787 0.86 PIK3CG (0.76) PIK3CGPIK3CAIGF1RRXRAINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501509-A4 ARYL-LINK-ARYL SUBSTITUTED THIAZOLIDINE-DIONE AND OXAZOLIDINE-DIONE AS SODIUM CHANNEL BLOCKERS MERCK & CO INC (US) 2009-07-15 EP disclosed
US-7348348-B2 Aryl-link-aryl substituted thiazolidine-dione and oxazolidine-dione as sodium channel blockers MERCK & CO. INC. (US) 2008-03-25 US disclosed
US-7348348-B2 Aryl-link-aryl substituted thiazolidine-dione and oxazolidine-dione as sodium channel blockers MERCK & CO. INC. (US) 2008-03-25 US disclosed
US-7348348-B2 Aryl-link-aryl substituted thiazolidine-dione and oxazolidine-dione as sodium channel blockers MERCK & CO. INC. (US) 2008-03-25 US disclosed
US-20050165072-A1 Aryl-link-aryl substituted thiazolidine-dione and oxazolidine-dione as sodium channel blockers MERCK SHARP & DOHME CORP. 2005-07-28 US disclosed
EP-1501509-A2 ARYL-LINK-ARYL SUBSTITUTED THIAZOLIDINE-DIONE AND OXAZOLIDINE-DIONE AS SODIUM CHANNEL BLOCKERS Merck & Co., Inc. (US) 2005-02-02 EP disclosed
WO-2004024061-A2 ARYL-LINK-ARYL SUBSTITUTED THIAZOLIDINE-DIONE AND OXAZOLIDINE-DIONE AS SODIUM CHANNEL BLOCKERS MERCK & CO., INC. (US) 2004-03-25 WO 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-20050165072-A1 Aryl-link-aryl substituted thiazolidine-dione and oxazolidine-dione as sodium channel blockers KCNN1, KCNH1, KCNN2 PIK3CG 4236/4885PIK3CA 4382/4885IGF1R 908/4885

“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.