SCHEMBL12584635

SCHEMBL12584635

O=S(=O)(Nc1ccc(Oc2cncc(Cl)c2)c(F)c1)c1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.67
CYP3A4 P08684 2/20 0.48
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
KMT2A Q03164 2/20 0.47
SLC22A12 Q96S37 1/20 0.46

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
SCHEMBL12584660 0.89 PPARG (0.67) PPARGCYP3A4KEAP1NFE2L2KMT2A
SCHEMBL12584605 0.85 PPARG (0.68) PPARGCYP3A4SLC22A12
SCHEMBL12584627 0.82 PPARG (0.64) PPARGCYP3A4KMT2ASLC22A12
SCHEMBL12584637 0.81 PPARG (0.63) PPARGCYP3A4SLC22A12
SCHEMBL4694848 0.80 PPARG (0.80) PPARGCYP3A4
SCHEMBL12584622 0.80 PPARG (1.00) PPARGCYP3A4
SCHEMBL2035944 0.77 PPARG (0.67) PPARGCYP3A4
SCHEMBL3993719 0.72 KMT2A (0.65) CYP3A4KEAP1NFE2L2KMT2A
SCHEMBL12632891 0.72 PPARG (0.66) PPARGCYP3A4KMT2A
SCHEMBL4696116 0.72 PPARG (0.75) PPARGCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968567-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2011-06-28 US disclosed
US-7968567-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2011-06-28 US disclosed
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY AMGEN INC. (US) 2010-05-06 US disclosed
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY AMGEN INC. (US) 2010-05-06 US disclosed
US-7626033-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2009-12-01 US disclosed
US-7626033-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2009-12-01 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-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY PPARG, PPARA, PPARD PPARG 1/4885CYP3A4 1165/4885KEAP1 3447/4885

“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.