SCHEMBL4841268

SCHEMBL4841268

CCOC(=O)CCc1ccc(OCc2cccc(-c3ccc(C(F)(F)F)cc3)c2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.56
PPARD Q03181 8/20 0.54
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
FFAR4 Q5NUL3 1/20 0.50
PRKD3 O94806 1/20 0.48
S1PR1 P21453 1/20 0.48
CDK7 P50613 1/20 0.48
JAK3 P52333 1/20 0.48
TNK2 Q07912 1/20 0.48
S1PR5 Q9H228 1/20 0.48
RXRA P19793 1/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47

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
SCHEMBL4835765 0.89 FFAR1 (0.71) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12571007 0.84 FFAR1 (0.78) FFAR1FFAR4
SCHEMBL1549560 0.84 PPARD (0.54) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL5860709 0.82 PPARD (0.59) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL1746661 0.80 FFAR1 (0.68) FFAR1PPARDPPARGFFAR4
SCHEMBL1746560 0.79 FFAR1 (0.67) FFAR1PPARDFFAR4
SCHEMBL1745038 0.79 FFAR1 (0.79) FFAR1FFAR4
SCHEMBL1745405 0.78 FFAR1 (0.83) FFAR1FFAR4
SCHEMBL1745469 0.78 FFAR1 (0.60) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL16354320 0.78 FFAR1 (0.65) FFAR1PPARDPPARAPPARGFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7338960-B2 Phenylalkanoic acid and phenyloxyalkanoic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 US disclosed
US-7338960-B2 Phenylalkanoic acid and phenyloxyalkanoic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 US disclosed
US-7338960-B2 Phenylalkanoic acid and phenyloxyalkanoic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 US disclosed
EP-1513526-B1 PHENYLALKANOIC ACID AND PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORP (US) 2007-11-07 EP disclosed
US-20060089394-A1 Phenylalkanoic acid and phenyloxyalkanoic acid derivatives as hppar activators SMITHKLINE BEECHAM CORPORATION 2006-04-27 US disclosed
EP-1513526-A1 PHENYLALKANOIC ACID AND PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2005-03-16 EP disclosed
WO-2004000315-A1 PHENYLALKANOIC ACID AND PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-31 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-20060089394-A1 Phenylalkanoic acid and phenyloxyalkanoic acid derivatives as hppar activators LIPA, PNLIP, CEL FFAR1 22/4885PPARD 83/4885PPARA 11/4885

“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.