SCHEMBL6025545

SCHEMBL6025545

Cc1cnc2c(C(F)(F)F)cccc2c1-c1cccc(OCc2ccc(CC(=O)Oc3cccc(-c4c(C)cnc5c(C(F)(F)F)cccc45)c3)cc2)c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 0.65
NR1H3 Q13133 18/20 0.65
PPARG P37231 1/20 0.65
PPARD Q03181 1/20 0.65
PPARA Q07869 1/20 0.65

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
SCHEMBL1125012 0.91 NR1H2 (0.77) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL6025542 0.88 NR1H2 (0.73) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125475 0.87 NR1H2 (0.77) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125342 0.86 NR1H2 (0.61) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125398 0.86 NR1H2 (0.67) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1126075 0.85 NR1H2 (0.65) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125138 0.85 NR1H2 (0.77) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125312 0.85 NR1H2 (0.65) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125466 0.85 NR1H2 (0.65) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125674 0.85 NR1H2 (0.69) NR1H2NR1H3PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692111-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE Wyeth, A Corporation of the State of Delaware (US) 2006-08-23 EP disclosed
WO-2005058834-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE WYETH (US) 2005-06-30 WO disclosed