SCHEMBL4688952

SCHEMBL4688952

C=CCc1cc(CNC(=O)c2cc(-c3ccc(C(C)(C)C)cc3)nn2C)ccc1OC(C)(C)C(=O)OCC

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.65
PPARA Q07869 16/20 0.65
PPARD Q03181 9/20 0.65
PHGDH O43175 1/20 0.42
GALR3 O60755 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL2807596 0.91 PPARG (0.76) PPARGPPARAPPARDPHGDH
SCHEMBL4694833 0.88 PPARA (0.82) PPARGPPARAPPARD
SCHEMBL4691381 0.87 PPARG (0.71) PPARGPPARAPPARDPHGDH
SCHEMBL4787025 0.84 PPARA (0.80) PPARGPPARAPPARDPHGDHRAB9A
SCHEMBL4691715 0.83 PPARG (0.60) PPARGPPARAPPARDPHGDHGALR3
SCHEMBL4695991 0.82 PPARG (0.84) PPARGPPARAPPARD
SCHEMBL4750579 0.81 PPARG (0.66) PPARGPPARAPPARDPHGDH
SCHEMBL2787266 0.81 PPARG (0.79) PPARGPPARAPPARDPHGDH
SCHEMBL4695138 0.80 PPARG (0.72) PPARGPPARAPPARDPHGDH
SCHEMBL4689581 0.80 PPARG (0.69) PPARGPPARAPPARDPHGDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685113-B1 SUBSTITUTED PYRAZOLES AS PPAR AGONISTS SMITHKLINE BEECHAM CORP (US) 2008-07-30 EP disclosed
US-20080021030-A1 Substituted Pyrazoles As Ppar Agonists SMITHKLINE BEECHAM CORPORATION 2008-01-24 US disclosed
US-20080021030-A1 Substituted Pyrazoles As Ppar Agonists SMITHKLINE BEECHAM CORPORATION 2008-01-24 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-20080021030-A1 Substituted Pyrazoles As Ppar Agonists PPARD, PPARA, PPARG PPARG 3/4885PPARA 2/4885PPARD 1/4885

“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.