SCHEMBL12096828

SCHEMBL12096828

COc1cc(Cc2cc3cc(C(F)(F)F)ccc3n2S(=O)(=O)c2ccc(C(C)C)cc2)ccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.53
▸ PPARA Q07869 10/20 0.53
▸ PPARD Q03181 8/20 0.53
▸ RORC P51449 2/20 0.38
▸ PHGDH O43175 1/20 0.37
▸ CETP P11597 2/20 0.37
▸ AVPR2 P30518 1/20 0.36
▸ GPR27 Q9NS67 1/20 0.36
▸ PDE2A O00408 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSD17B10 Q99714 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
SCHEMBL12096983 0.90 PPARG (0.51) PPARGPPARAPPARDRORCPHGDH
SCHEMBL12096783 0.89 PPARG (0.53) PPARGPPARAPPARDRORC
SCHEMBL12096899 0.89 PPARG (0.51) PPARGPPARAPPARDRORCPHGDH
SCHEMBL12096672 0.88 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL12096737 0.85 PPARG (0.54) PPARGPPARAPPARDRORC
SCHEMBL12096705 0.85 PPARG (0.49) PPARGPPARAPPARDRORCPHGDH
SCHEMBL12096925 0.85 PPARG (0.54) PPARGPPARAPPARDRORCKDM4E
SCHEMBL12096818 0.81 PPARG (0.51) PPARGPPARAPPARDRORCPHGDH
SCHEMBL12096776 0.78 PPARG (0.68) PPARGPPARAPPARDRORCKDM4E
SCHEMBL12096673 0.78 PPARG (0.49) PPARGPPARAPPARD

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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