SCHEMBL12096609

SCHEMBL12096609

CC(C)(C)c1cccc(S(=O)(=O)n2c(Cc3ccc(C(=O)O)s3)cc3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 13/20 0.51
▸ PPARA Q07869 11/20 0.51
▸ PPARD Q03181 8/20 0.51
▸ RORC P51449 4/20 0.41
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL14053991 0.86 TP53 (0.38) PPARGPPARAPPARDRORCTP53
SCHEMBL12096781 0.85 PPARG (0.50) PPARGPPARAPPARDRORCTP53
SCHEMBL12099652 0.84 PPARG (0.45) PPARGPPARAPPARDRORCTP53
SCHEMBL12096630 0.83 PPARG (0.51) PPARGPPARAPPARDRORC
SCHEMBL12096713 0.83 PPARG (0.53) PPARGPPARAPPARDRORC
SCHEMBL12097011 0.83 CYP3A4 (0.39) PPARGPPARAPPARDRORCCYP3A4
SCHEMBL27936046 0.83 PPARG (0.37) PPARGPPARAPPARDTP53MAPT
SCHEMBL12096710 0.83 POLB (0.53) PPARGPPARAPPARDRORCCYP2C9
SCHEMBL18580379 0.82 PPARG (0.56) PPARGPPARAPPARDRORCTP53
SCHEMBL12099650 0.82 PPARG (0.52) 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 2 patents. 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 claimed
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.

Send feedback