SCHEMBL6357733

SCHEMBL6357733

CCOCCC(=O)N(CCc1cccc(OC(C)(CC)C(=O)O)c1)CCc1ccc(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.49
PPARA Q07869 8/20 0.49
PPARD Q03181 2/20 0.38
FFAR1 O14842 3/20 0.37
ADRB2 P07550 2/20 0.37
RIPK1 Q13546 2/20 0.37
CYP2D6 P10635 3/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35

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
SCHEMBL6363524 0.91 PPARG (0.52) PPARGPPARAPPARDRIPK1BCL9
SCHEMBL6359444 0.90 PPARA (0.57) PPARGPPARAPPARDCYP2D6
SCHEMBL7596460 0.89 PPARA (0.58) PPARGPPARAPPARDCYP2D6
SCHEMBL6358170 0.87 PPARG (0.49) PPARGPPARAPPARDRIPK1CYP2D6
SCHEMBL6359776 0.86 PPARA (0.46) PPARGPPARAPPARDRIPK1BCL9
SCHEMBL6363205 0.83 PPARG (0.46) PPARGPPARAPPARDRIPK1BCL9
SCHEMBL6357777 0.83 PPARA (0.46) PPARGPPARAPPARDRIPK1CYP2D6
SCHEMBL6363391 0.82 PPARA (0.60) PPARGPPARAPPARDCYP2D6
SCHEMBL6363503 0.81 PPARA (0.61) PPARGPPARAPPARDCYP2D6
SCHEMBL6358999 0.81 PPARA (0.61) PPARGPPARAPPARDCYP2D6

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 PPARG 2/4885PPARA 1/4885PPARD 3/4885
US-20050075377-A1 PPAR compounds PPARA, PPARG, PPARD PPARG 2/4885PPARA 1/4885PPARD 3/4885

“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.