SCHEMBL4575071

SCHEMBL4575071

CCCc1cc(C(C)(C)CN(Cc2ccc(OC(F)(F)F)cc2)c2ccccn2)ccc1OC(C)(C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
PPARA Q07869 14/20 0.40
PPARD Q03181 13/20 0.40
PPARG P37231 9/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 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
SCHEMBL14277963 0.91 PPARD (0.46) LMNAPPARAPPARDPPARGMEN1
SCHEMBL4575134 0.85 PPARA (0.41) PPARAPPARDPPARGTRPM8NR1H2
SCHEMBL4575895 0.78 PPARA (0.44) LMNAPPARAPPARDPPARGMEN1
SCHEMBL4575015 0.76 PPARD (0.47) PPARAPPARDPPARGTRPM8NR1H2
SCHEMBL4575374 0.75 PPARA (0.52) LMNAPPARAPPARDPPARGMEN1
SCHEMBL4575482 0.74 PPARA (0.43) PPARAPPARDPPARGTRPM8
SCHEMBL4575080 0.74 PPARA (0.47) PPARAPPARDPPARGTRPM8
SCHEMBL4575338 0.72 PPARA (0.42) PPARAPPARDPPARGTRPM8
SCHEMBL4575631 0.70 PPARA (0.54) LMNAPPARAPPARDPPARGBLM
SCHEMBL4574823 0.70 NR1H2 (0.40) TRPM8NR1H2NR1H3

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-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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 (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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD LMNA 3670/4885PPARA 2/4885PPARD 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.