SCHEMBL12096840

SCHEMBL12096840

O=C(O)c1ccc(Cc2cc3cc(Cl)ccc3n2S(=O)(=O)c2ccc(-c3cccc(F)c3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 9/20 0.51
▸ PPARG P37231 9/20 0.49
▸ PPARA Q07869 7/20 0.49
▸ PPARD Q03181 6/20 0.49
▸ TRPM8 Q7Z2W7 1/20 0.42

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
SCHEMBL12096663 0.92 ACLY (0.55) ACLYPPARGPPARAPPARD
SCHEMBL12096908 0.92 PPARG (0.58) ACLYPPARGPPARAPPARD
SCHEMBL12096917 0.90 PPARG (0.53) ACLYPPARGPPARAPPARD
SCHEMBL12096712 0.89 PPARG (0.53) ACLYPPARGPPARAPPARD
SCHEMBL12096655 0.87 PPARG (0.57) ACLYPPARGPPARAPPARD
SCHEMBL12096700 0.84 ACLY (0.52) ACLYPPARGPPARAPPARD
SCHEMBL12096838 0.84 PPARG (0.57) ACLYPPARGPPARAPPARD
SCHEMBL12096688 0.84 PPARG (0.55) ACLYPPARGPPARAPPARD
SCHEMBL27884317 0.83 ACLY (0.40) ACLYPPARGPPARAPPARDTRPM8
SCHEMBL12096833 0.83 ACLY (0.51) ACLYPPARGPPARAPPARD

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 ACLY 3538/4885PPARG 423/4885PPARA 564/4885

“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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