SCHEMBL1125893

SCHEMBL1125893

Fc1ccccc1COc1cccc(-c2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.73
NR1H3 Q13133 19/20 0.73
RXRA P19793 1/20 0.73
PPARG P37231 2/20 0.72
PPARD Q03181 1/20 0.72
PPARA Q07869 1/20 0.72

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
SCHEMBL1125618 0.93 NR1H2 (0.75) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125345 0.90 NR1H2 (0.67) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125504 0.90 NR1H2 (0.67) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125184 0.90 NR1H2 (0.75) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125610 0.90 NR1H2 (0.72) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125586 0.90 NR1H2 (0.76) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125090 0.89 NR1H2 (0.73) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1124889 0.89 NR1H2 (0.76) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1125425 0.89 NR1H2 (0.80) NR1H2NR1H3RXRAPPARGPPARD
SCHEMBL1126230 0.89 NR1H2 (0.65) NR1H2NR1H3RXRAPPARGPPARD

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-2284157-A1 Quinolines useful in treating cardiovascular disease Wyeth (US) 2011-02-16 EP claimed
US-7576215-B2 Quinolines and pharmaceutical compositions thereof WYETH (US) 2009-08-18 US claimed
JP-2007516258-A 2007-06-21 JP claimed
EP-1692111-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE Wyeth, A Corporation of the State of Delaware (US) 2006-08-23 EP claimed
WO-2005058834-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE WYETH (US) 2005-06-30 WO claimed
EP-2284157-A1 Quinolines useful in treating cardiovascular disease Wyeth (US) 2011-02-16 EP disclosed