SCHEMBL6357740

SCHEMBL6357740

CCCCCCCN(CCc1cccc(OC(C)(CC)C(=O)O)c1)S(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.54
PPARG P37231 7/20 0.54
BMP1 P13497 3/20 0.46
TAS2R14 Q9NYV8 3/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA4 P22748 2/20 0.44
CA9 Q16790 2/20 0.44
P4HB P07237 1/20 0.43
CETP P11597 1/20 0.42

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
SCHEMBL6545681 1.00 PPARA (0.54) PPARAPPARGBMP1TAS2R14CA12
SCHEMBL6363553 0.93 BMP1 (0.57) PPARAPPARGBMP1TAS2R14
SCHEMBL6357807 0.93 PPARA (0.53) PPARAPPARGBMP1TAS2R14CA12
SCHEMBL6363875 0.88 PPARA (0.54) PPARAPPARGCETP
SCHEMBL6545146 0.82 PPARA (0.52) PPARAPPARGBMP1TAS2R14
SCHEMBL6364742 0.82 PPARA (0.52) PPARAPPARGBMP1TAS2R14
SCHEMBL13508458 0.81 PPARG (0.64) PPARAPPARGBMP1TAS2R14CA12
SCHEMBL6359007 0.81 PPARA (0.61) PPARAPPARGCA12CA1CA2
SCHEMBL6363253 0.80 PPARA (0.57) PPARAPPARGCA12CA1CA2
SCHEMBL6364698 0.80 PPARA (0.58) PPARAPPARGCETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075377-A1 PPAR compounds PFIZER INC 2005-04-07 US disclosed
US-20020169192-A1 PPAR compounds HAYWARD CHERYL M (US) 2002-11-14 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 (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-20020169192-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885BMP1 2433/4885
US-20050075377-A1 PPAR compounds PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885BMP1 2433/4885

“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.