SCHEMBL2362775

SCHEMBL2362775

CC(C)c1ccc(S(=O)(=O)n2c(Cc3ccc(C(=O)O)cc3)cc3cc(Cl)ncc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 5/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ CCR9 P51686 2/20 0.39
▸ PPARG P37231 5/20 0.38
▸ PPARD Q03181 3/20 0.38
▸ IDH1 O75874 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.36
▸ PPARA Q07869 4/20 0.36
▸ ACLY P53396 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ YTHDC1 Q96MU7 1/20 0.35
▸ PTGER4 P35408 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
SCHEMBL14053889 0.90 IDH1 (0.40) RORCPPARGIDH1PPARAYTHDC1
SCHEMBL15520715 0.89 PPARG (0.37) RORCCCR9PPARGPPARDIDH1
SCHEMBL14054109 0.88 RORC (0.39) RORCRXRARXRBPPARGPPARD
SCHEMBL12096941 0.85 PPARG (0.52) PPARGPPARDPPARAACLY
SCHEMBL2365154 0.83 RXRA (0.39) RORCRXRARXRBPPARGPPARD
SCHEMBL12096737 0.80 PPARG (0.54) RORCPPARGPPARDPPARAPTGER4
SCHEMBL15520419 0.80 PPARG (0.41) RXRARXRBPPARGPPARDPPARA
SCHEMBL14054804 0.79 RORC (0.39) RORCPPARGPPARDIDH1PPARA
SCHEMBL2275980 0.79 SMN1; SMN2 (0.41) RORCRXRARXRBPPARGPPARD
SCHEMBL2279719 0.78 TRPM8 (0.43) RORC

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 12 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
EP-2521727-A1 NOVEL BENZOIC PYRROLOPYRIDINE DERIVATIVES Laboratoires Fournier S.A. (FR) 2012-11-14 — — EP claimed
WO-2011083278-A1 NOVEL BENZOIC PYRROLOPYRIDINE DERIVATIVES LABORATOIRES FOURNIER SA (FR) 2011-07-14 — — WO claimed
EP-2521727-B1 NEW BENZOIC PYRROLOPYRIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF PARKINSON'S DISEASE INVENTIVA (FR) 2014-03-19 — — EP 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-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 RORC 101/4885RXRA 82/4885RXRB 62/4885

“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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