SCHEMBL4574841

SCHEMBL4574841

Cc1ccc(N(CCc2ccc(O)cc2)Cc2ccc(C(F)(F)F)cc2)nc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ESRRG P62508 1/20 0.37
MCHR1 Q99705 4/20 0.35
UTS2R Q9UKP6 1/20 0.35
KIF11 P52732 1/20 0.35
MAOB P27338 1/20 0.34
BCHE P06276 1/20 0.34
AOC3 Q16853 1/20 0.34

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
SCHEMBL4575245 0.83 FFAR4 (0.37) NR1H2NR1H3KDM4ELMNAGAA
SCHEMBL4575335 0.82 PPARA (0.52)
SCHEMBL4575407 0.81 FFAR4 (0.33) KDM4ELMNAGAAHTTSMN1; SMN2
SCHEMBL4574711 0.79 CETP (0.43) BCHE
SCHEMBL4575880 0.78 NR1H2 (0.42) NR1H2NR1H3KDM4ELMNAGAA
SCHEMBL4575469 0.75 PPARD (0.48)
SCHEMBL4576207 0.75 PPARA (0.52)
SCHEMBL2414732 0.73 PPARA (0.38) KDM4ELMNASMN1; SMN2
SCHEMBL4575464 0.73 PPARA (0.54)
SCHEMBL14277953 0.72 KDM4E (0.30) KDM4ELMNAGAAHTTSMN1; SMN2

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 4 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-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 NR1H2 5/4885NR1H3 4/4885KDM4E 4112/4885

“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.