SCHEMBL4611690

SCHEMBL4611690

CCCC/C=C/C(=O)C(C)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F7 P08709 1/20 0.42
F3 P13726 1/20 0.42
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
PTPN1 P18031 1/20 0.39

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
SCHEMBL4611695 1.00 F7 (0.42) F7F3PPARGPPARACNR1
SCHEMBL7110020 0.94 PPARG (0.47) F7F3PPARGPPARACNR1
SCHEMBL7115034 0.87 TAS1R3 (0.46) PPARGPPARACNR1CNR2FFAR1
SCHEMBL31509214 0.87 TAS1R3 (0.46) PPARGPPARACNR1CNR2FFAR1
SCHEMBL454223 0.85 F7 (0.44) F7F3PPARGPPARACNR1
SCHEMBL454225 0.85 F7 (0.44) F7F3PPARGPPARACNR1
SCHEMBL8150368 0.79 PPARG (0.49) F7F3PPARGPPARAPTPN1
SCHEMBL8150365 0.79 PPARG (0.49) F7F3PPARGPPARAPTPN1
SCHEMBL14681838 0.78 PPARG (0.51) F7F3PPARGPPARAPTPN1
SCHEMBL9231091 0.76 PPARG (0.46) F7F3PPARGPPARACNR1

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
EP-1879860-A2 1,4-DIPHENYL-3-HYDROXYALKYL-2-AZETIDINONE DERIVATIVES FOR TREATING HYPERCHOLESTROLEMIA Microbia Inc. (US) 2008-01-23 EP disclosed
EP-1877373-A2 BIPHENYLAZETIDINONE CHOLESTEROL ABSORPTION INHIBITORS Microbia, Inc. (US) 2008-01-16 EP disclosed
WO-2006122186-A2 1,4-DIPHENYL-3-HYDROXYALKYL-2-AZETIDINONE DERIVATIVES FOR TREATING HYPERCHOLESTROLEMIA MICROBIA, INC. (US) 2006-11-16 WO disclosed
WO-2006121861-A2 BIPHENYLAZETIDINONE CHOLESTEROL ABSORPTION INHIBITORS MICROBIA, INC. (US) 2006-11-16 WO disclosed
US-20040176336-A1 Prevention of ovarian cancer by administration of products that induce biologic effects in the ovarian epithelium RODRIGUEZ GUSTAVO C (US) 2004-09-09 US disclosed
EP-1357193-A1 Preparation of pyrazines SOCIETE DES PRODUITS NESTLE S.A. (CH) 2003-10-29 EP disclosed