SCHEMBL4697780

SCHEMBL4697780

COc1ccc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2Oc2cncc(Cl)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.55
LMNA P02545 1/20 0.54
CCR2 P41597 3/20 0.52
CCR1 P32246 2/20 0.52
SLC22A12 Q96S37 1/20 0.49
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NAMPT P43490 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
HTR6 P50406 1/20 0.45
MDM2 Q00987 1/20 0.45
MAPK1 P28482 1/20 0.45
TRIM24 O15164 1/20 0.44
BRD1 O95696 1/20 0.44
BRPF1 P55201 1/20 0.44

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
SCHEMBL4697760 0.93 CCR2 (0.56) PPARGCCR2CCR1SLC22A12CYP3A4
SCHEMBL4696965 0.89 PPARG (0.54) PPARGCCR2CCR1SLC22A12CYP3A4
SCHEMBL4696893 0.83 PPARG (0.58) PPARGLMNACCR2SLC22A12CYP3A4
SCHEMBL12584711 0.82 PPARG (0.65) PPARGLMNASLC22A12CYP3A4KMT2A
SCHEMBL4696073 0.81 PPARG (0.69) PPARGCYP3A4
SCHEMBL12584598 0.77 PPARG (0.66) PPARGSLC22A12CYP3A4
SCHEMBL5665407 0.74 CCR2 (0.79) CCR2CCR1MAPTKDM4ECYP3A4
SCHEMBL1471705 0.74 AXL (0.53) LMNACCR2CCR1MAPTGAA
SCHEMBL4807828 0.74 PPARG (0.77) PPARGLMNACYP3A4GAA
SCHEMBL14031307 0.73 CYP19A1 (0.61) PPARGLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1657244-B1 2-thiaquinolizidines as glycosidase and glycosyltransferase inhibitors UNIV MICHIGAN STATE (US) 2008-10-15 EP claimed
EP-1053227-B1 PPAR-GAMMA MODULATORS AMGEN INC (US) 2008-11-05 EP disclosed
US-7439242-B2 PPARγ modulators AMGEN INC. (US) 2008-10-21 US disclosed
US-7439242-B2 PPARγ modulators AMGEN INC. (US) 2008-10-21 US disclosed
US-7439242-B2 PPARγ modulators AMGEN INC. (US) 2008-10-21 US disclosed
US-6620827-B2 Peroxisome proliferator-activated receptors-gamma to control lipid metabolism ane obesity; antidiabetic, -inflammatory and -arthritic agents; non-insulin dependent diabetes; antilipemic and -cholesterol agents TULARIK INC. 2003-09-16 US disclosed
US-20030088103-A1 PPARgamma modulators TULARIK INC. (US) 2003-05-08 US disclosed
US-20010027200-A1 PPARgamma modulators TULARIK INC. 2001-10-04 US disclosed
US-6200995-B1 PYRIDYLOXYBENZENESULFONAMIDE DERIVATIVES; DIABETES, OBESITY TULARIK INC. 2001-03-13 US disclosed
EP-1053227-A1 PPAR-GAMMA MODULATORS TULARIK, INC. (US) 2000-11-22 EP disclosed
WO-1999038845-A1 PPAR-GAMMA MODULATORS TULARIK INC. (US) 1999-08-05 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 (2 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-20030088103-A1 PPARgamma modulators PPARG, PPARA, PPARD PPARG 1/4885LMNA 2066/4885CCR2 1544/4885
US-20010027200-A1 PPARgamma modulators PPARG, PPARA, PPARD PPARG 1/4885LMNA 2066/4885CCR2 1544/4885

“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.