SCHEMBL7932743

SCHEMBL7932743

CCOC(Cc1ccc(-c2ccccc2/C=C/I)cc1)OC

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.34
PPARG P37231 13/20 0.34
PPARD Q03181 8/20 0.33
MME P08473 2/20 0.32
MMEL1 Q495T6 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL7922729 0.84 XDH (0.38) PPARAPPARGPPARDMMEMMEL1
SCHEMBL7922792 0.81 PTGS2 (0.39)
SCHEMBL7922722 0.76 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL8177775 0.76 PPARD (0.40) PPARAPPARGPPARD
SCHEMBL7922963 0.75 MAOB (0.36) PPARAPPARGFFAR1FFAR4
SCHEMBL7922968 0.75 MAOB (0.36) PPARAPPARGFFAR1FFAR4
SCHEMBL7922790 0.74 PTGER1 (0.34) FFAR1FFAR4
SCHEMBL7922795 0.74 PTGER1 (0.34) FFAR1FFAR4
SCHEMBL7932747 0.72 FFAR1 (0.33) FFAR1FFAR4
SCHEMBL7929362 0.71 FYN (0.38) FFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879814-B1 Triaromatic compounds, compositions containing them and uses thereof CT INTERNAT DE BR RECH S DERMA (FR) 2001-11-28 EP disclosed
US-6150413-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2000-11-21 US disclosed
EP-0879814-A1 Triaromatic compounds, compositions containing them and uses thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-11-25 EP disclosed