SCHEMBL1997363

SCHEMBL1997363

O=S(=O)(Nc1cc(Cl)cc(Oc2nc3ccc(Cl)cc3s2)c1)c1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.49
CYP3A4 P08684 5/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
MCL1 Q07820 1/20 0.40
P2RX1 P51575 1/20 0.39
PDPK1 O15530 1/20 0.39
SGK1 O00141 1/20 0.38

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
SCHEMBL2002294 0.94 PPARG (0.49) PPARGCYP3A4PTGDR2MCL1SGK1
SCHEMBL2001225 0.93 PPARG (0.49) PPARGCYP3A4PTGDR2GAAMAPT
SCHEMBL2000221 0.92 PPARG (0.47) PPARGCYP3A4PTGDR2GAAMAPT
SCHEMBL2003082 0.91 PPARG (0.47) PPARGCYP3A4PTGDR2MAPT
SCHEMBL1994385 0.91 PPARG (0.49) PPARGCYP3A4GAAMAPTMCL1
SCHEMBL2004784 0.91 PPARG (0.50) PPARGCYP3A4PDPK1
SCHEMBL1996544 0.89 PPARG (0.51) PPARGCYP3A4GAAMAPTMCL1
SCHEMBL1998785 0.89 PPARG (0.57) PPARGCYP3A4GAAMAPTMCL1
SCHEMBL1996053 0.87 PPARG (0.48) PPARGCYP3A4
SCHEMBL1998403 0.86 PTGDR2 (0.45) PPARGCYP3A4PTGDR2GAAMAPT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960408-B2 Quinolinyl and benzothiazolyl modulators AMGEN INC. (US) 2011-06-14 US disclosed
US-7601841-B2 Quinolinyl and benzothiazolyl modulators AMGEN INC. (US) 2009-10-13 US disclosed
US-20090221635-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS AMGEN INC. (US) 2009-09-03 US disclosed
EP-1296967-B1 BENZOTHIAZOLYL PPAR-GAMMA MODULATORS AMGEN INC (US) 2006-05-31 EP disclosed
US-20040176409-A1 Quinolinyl and benzothiazolyl modulators TULARIK INC 2004-09-09 US disclosed
US-20030171399-A1 Quinolinyl and benzothiazolyl modulators TULARIK INC. 2003-09-11 US disclosed
US-6583157-B2 Peroxisome proliferator-activated receptors antagonists; antiinflammatory agents and treating metabolic disorders TULARIK INC. 2003-06-24 US disclosed
EP-1296967-A1 QUINOLINYL AND BENZOTHIAZOLYL PPAR-GAMMA MODULATORS Tularik Inc. (US) 2003-04-02 EP disclosed
US-20020169185-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS AMGEN INC. 2002-11-14 US disclosed
WO-2002000633-A1 QUINOLINYL AND BENZOTHIAZOLYL PPAR-GAMMA MODULATORS TULARIK INC. (US) 2002-01-03 WO 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 (4 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-20040176409-A1 Quinolinyl and benzothiazolyl modulators PPARA, PPARG, PPARD PPARG 2/4885CYP3A4 675/4885PTGDR2 814/4885
US-20030171399-A1 Quinolinyl and benzothiazolyl modulators PPARA, PPARG, PPARD PPARG 2/4885CYP3A4 675/4885PTGDR2 814/4885
US-20020169185-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS PPARA, PPARG, PPARD PPARG 2/4885CYP3A4 675/4885PTGDR2 814/4885
US-20090221635-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS PPARG, PPARA, PPARD PPARG 1/4885CYP3A4 772/4885PTGDR2 916/4885

“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.