SCHEMBL12096867

SCHEMBL12096867

CC(C)c1ccc(S(=O)(=O)n2c(C(O)c3ccc(C(=O)O)cc3)cc3cc(C(F)(F)F)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 9/20 0.47
▸ PPARA Q07869 8/20 0.47
▸ PPARD Q03181 7/20 0.47
▸ ACLY P53396 2/20 0.39
▸ RORC P51449 1/20 0.38
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ PHGDH O43175 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ SRD5A2 P31213 1/20 0.36
▸ NOD1 Q9Y239 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL12096771 0.91 PPARG (0.45) PPARGPPARAPPARDACLYRORC
SCHEMBL12096852 0.86 ACLY (0.53) PPARGPPARAPPARDACLYPHGDH
SCHEMBL12096836 0.86 PPARG (0.43) PPARGPPARAPPARDACLYPHGDH
SCHEMBL12096891 0.85 PPARG (0.45) PPARGPPARAPPARDACLYRORC
SCHEMBL12096737 0.84 PPARG (0.54) PPARGPPARAPPARDRORCSRD5A2
SCHEMBL12096834 0.82 PPARG (0.46) PPARGPPARAPPARDRORCCA12
SCHEMBL12096777 0.81 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL12096645 0.79 RXRA (0.41) PPARGPPARAPPARDACLYCA12
SCHEMBL12096606 0.77 PPARG (0.45) PPARGPPARAPPARDRORCSMN1; SMN2
SCHEMBL12096605 0.77 PPARG (0.45) PPARGPPARAPPARDRORCSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease LABORATOIRES FOURNIER SA (FR) 2012-09-13 — — 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-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease NCOR1, NR0B1, MTNR1A PPARG 423/4885PPARA 564/4885PPARD 302/4885

“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.

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