SCHEMBL1126259

SCHEMBL1126259

N#CNC(=Nc1ccccc1F)Nc1cccc(-c2c(C(=O)c3ccccc3)cnc3c(C(F)(F)F)cccc23)c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.60
NR1H3 Q13133 19/20 0.60

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
SCHEMBL1125958 0.92 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL1126031 0.91 NR1H2 (0.63) NR1H2NR1H3
SCHEMBL1125890 0.88 NR1H2 (0.63) NR1H2NR1H3
SCHEMBL1126026 0.84 NR1H2 (0.67) NR1H2NR1H3
SCHEMBL1126028 0.84 NR1H2 (0.67) NR1H2NR1H3
SCHEMBL1126253 0.84 NR1H2 (0.61) NR1H2NR1H3
SCHEMBL1126257 0.84 NR1H2 (0.61) NR1H2NR1H3
SCHEMBL3854059 0.82 NR1H2 (0.77) NR1H2NR1H3
SCHEMBL1125104 0.81 NR1H2 (0.68) NR1H2NR1H3
SCHEMBL3859944 0.81 NR1H2 (0.75) NR1H2NR1H3

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 4 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
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