SCHEMBL6052086

SCHEMBL6052086

Cn1nc(CCOc2ccc(CC3SC(=O)NC3=O)cc2)nc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.57
FFAR1 O14842 9/20 0.55
CYP3A4 P08684 1/20 0.52
RXRA P19793 1/20 0.52
PPARA Q07869 2/20 0.51
HRH3 Q9Y5N1 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
SCHEMBL6052099 0.82 HRH3 (0.40) PPARGFFAR1CYP3A4PPARAHRH3
SCHEMBL4283015 0.78 PPARG (0.63) PPARGCYP3A4PPARA
SCHEMBL170065 0.78 PPARG (0.63) PPARGCYP3A4PPARA
SCHEMBL12515224 0.78 FFAR1 (0.69) PPARGFFAR1CYP3A4RXRAPPARA
SCHEMBL8458527 0.77 FFAR1 (0.54) PPARGFFAR1CYP3A4RXRAHRH3
SCHEMBL6356578 0.77 PPARG (0.68) PPARGFFAR1PPARAHRH3
SCHEMBL1072226 0.77 FFAR1 (0.77) PPARGFFAR1CYP3A4PPARAHRH3
SCHEMBL5935692 0.76 PPARG (0.69) PPARGFFAR1PPARAHRH3
SCHEMBL8304608 0.75 PPARG (0.55) PPARGFFAR1RXRAPPARAHRH3
SCHEMBL8390608 0.75 PPARG (0.66) PPARGFFAR1RXRAPPARAHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047423-B1 NOVEL APOPTOSIS INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2006-05-10 EP disclosed
US-20020086883-A1 Compound, such as pioglitazone, having an insulin sensitivity enhancing activity for the prophylaxis or treatment of a disease mediated by promotion of apoptosis, such as neurodegenerative disease TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2002-07-04 US disclosed
US-6399639-B1 ADMINISTERING A 2,4-THIADIAZOLIDINEDIONE COMPOUND TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-04 US disclosed
US-6087384-A TREATING PROPHYLAXIS AND TREATMENT OF A DISEASE ASSOCIATE WITH DEATH OF CELLS CAUSED BY VIRAL DISEASES, MYELODYSPLASIS, NEURODEGENERATIVE, ISCHEMIC AND HEPATIC DISEASES WITH A COMPOUND HAVING AN INSULIN SENSITIVITY ENHANCING ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-07-11 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 (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-20020086883-A1 Compound, such as pioglitazone, having an insulin sensitivity enhancing activity for the prophylaxis or treatment of a disease mediated by promotion of apoptosis, such as neurodegenerative disease IRS1, IAPP, AIFM1 PPARG 51/4885FFAR1 340/4885CYP3A4 1321/4885

“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.