SCHEMBL14053566

SCHEMBL14053566

CC(C)(C)c1cccc(S(=O)(=O)n2c(Cc3ccc(F)c(C(=O)O)c3)cc3cc(C(F)(F)F)ncc32)c1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 8/20 0.39
▸ PPARA Q07869 7/20 0.39
▸ PPARD Q03181 5/20 0.39
▸ RORC P51449 4/20 0.37
▸ MRGPRX4 Q96LA9 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
SCHEMBL14054024 0.90 PPARG (0.40) PPARGPPARAPPARDRORC
SCHEMBL12096634 0.88 PPARG (0.52) PPARGPPARAPPARDRORCMRGPRX4
SCHEMBL14124693 0.88 MRGPRX4 (0.41) PPARGPPARAPPARDRORCMRGPRX4
SCHEMBL14053938 0.85 PPARG (0.38) PPARGPPARAPPARDRORCMRGPRX4
SCHEMBL14054058 0.84 PPARG (0.38) PPARGPPARAPPARDRORC
SCHEMBL12096707 0.82 PPARG (0.51) PPARGPPARAPPARDRORC
SCHEMBL14124687 0.82 PPARG (0.41) PPARGPPARAPPARDRORC
SCHEMBL15520693 0.82 PPARG (0.41) PPARGPPARAPPARDRORC
SCHEMBL15520766 0.81 PPARG (0.38) PPARGPPARAPPARDRORC
SCHEMBL14058394 0.81 PPARG (0.38) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2521727-B1 NEW BENZOIC PYRROLOPYRIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PARKINSON'S DISEASE INVENTIVA (FR) 2014-03-19 — — EP claimed
US-8546385-B2 Benzoic pyrrolopyridine derivatives LABORATOIRES FOURNIER SA (FR) 2013-10-01 — — US claimed
US-20120302560-A1 Novel Benzoic Pyrrolopyridine Derivatives LABORATOIRES FOURNIER SA (FR) 2012-11-29 — — US claimed
US-8546385-B2 Benzoic pyrrolopyridine derivatives LABORATOIRES FOURNIER SA (FR) 2013-10-01 — — US disclosed
US-8546385-B2 Benzoic pyrrolopyridine derivatives LABORATOIRES FOURNIER SA (FR) 2013-10-01 — — US disclosed
US-8546385-B2 Benzoic pyrrolopyridine derivatives LABORATOIRES FOURNIER SA (FR) 2013-10-01 — — US disclosed
US-20120302560-A1 Novel Benzoic Pyrrolopyridine Derivatives LABORATOIRES FOURNIER SA (FR) 2012-11-29 — — US disclosed
US-20120302560-A1 Novel Benzoic Pyrrolopyridine Derivatives LABORATOIRES FOURNIER SA (FR) 2012-11-29 — — US disclosed
US-20120302560-A1 Novel Benzoic Pyrrolopyridine Derivatives LABORATOIRES FOURNIER SA (FR) 2012-11-29 — — 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-20120302560-A1 Novel Benzoic Pyrrolopyridine Derivatives NCOR1, NCOR2, NR0B1 PPARG 133/4885PPARA 151/4885PPARD 35/4885

“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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