SCHEMBL12096875

SCHEMBL12096875

CC(C)(C)c1cccc(S(=O)(=O)n2c(Cc3ccc(C(=O)NS(=O)(=O)c4ccccc4)cc3)cc3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 17/20 0.53
▸ PPARA Q07869 6/20 0.51
▸ PPARD Q03181 5/20 0.49
▸ PTPN1 P18031 1/20 0.46
▸ RORC P51449 1/20 0.43
▸ PTGER4 P35408 1/20 0.43

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
SCHEMBL12096753 0.90 PPARG (0.49) PPARGPPARAPPARDRORC
SCHEMBL12096713 0.90 PPARG (0.53) PPARGPPARAPPARDRORC
SCHEMBL18580379 0.88 PPARG (0.56) PPARGPPARAPPARDRORC
SCHEMBL12096774 0.87 PPARG (0.53) PPARGPPARAPPARDRORC
SCHEMBL12096743 0.86 PPARG (0.48) PPARGPPARAPPARDRORC
SCHEMBL12096747 0.85 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL12099650 0.84 PPARG (0.52) PPARGPPARAPPARDRORC
SCHEMBL12096640 0.83 RORC (0.46) PPARGPPARAPPARDRORC
SCHEMBL12096746 0.83 PPARG (0.48) PPARGPPARAPPARDRORC
SCHEMBL12096657 0.82 PPARG (0.53) PPARGPPARAPPARDRORC

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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