SCHEMBL2003181

SCHEMBL2003181

Cc1cc(S(=O)(=O)Nc2cc(Cl)c(Oc3nc4c(Cl)cccc4s3)c(Cl)c2)c(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PPARG P37231 10/20 0.41
CYP3A4 P08684 6/20 0.41
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
LMNA P02545 2/20 0.40
THRB P10828 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
PGR P06401 1/20 0.37
ALPL P05186 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL2002325 0.91 ALPL (0.43) MEN1KMT2APPARGCYP3A4HSD17B1
SCHEMBL2003942 0.88 PPARG (0.40) MEN1KMT2APPARGCYP3A4HSD17B1
SCHEMBL2001475 0.86 PPARG (0.54) MEN1KMT2APPARGCYP3A4LMNA
SCHEMBL1999994 0.82 FBP1 (0.41) MEN1KMT2APPARGCYP3A4HSD17B1
SCHEMBL2000734 0.82 PPARG (0.57) PPARGCYP3A4LMNA
SCHEMBL1999299 0.80 PPARG (0.55) PPARGCYP3A4LMNA
SCHEMBL2000558 0.80 TP53 (0.41) MEN1KMT2APPARGCYP3A4HSD17B1
SCHEMBL2001614 0.78 PPARG (0.50) MEN1KMT2APPARGCYP3A4ALPL
SCHEMBL2004571 0.77 RORC (0.43) PPARGCYP3A4LMNATP53ALPL
SCHEMBL2004274 0.75 PPARG (0.53) MEN1KMT2APPARGCYP3A4LMNA

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 MEN1 4858/4885KMT2A 2448/4885PPARG 2/4885
US-20030171399-A1 Quinolinyl and benzothiazolyl modulators PPARA, PPARG, PPARD MEN1 4858/4885KMT2A 2448/4885PPARG 2/4885
US-20020169185-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS PPARA, PPARG, PPARD MEN1 4858/4885KMT2A 2448/4885PPARG 2/4885
US-20090221635-A1 QUINOLINYL AND BENZOTHIAZOLYL MODULATORS PPARG, PPARA, PPARD MEN1 4860/4885KMT2A 2222/4885PPARG 1/4885

“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.