SCHEMBL4013303

SCHEMBL4013303

CS(=O)(=O)c1cccc(-c2cccc(-c3c(-c4ccccc4)cnc4c(C(F)(F)F)cccc34)c2)c1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.77
NR1H3 Q13133 19/20 0.77

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
SCHEMBL4013518 0.89 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL4014421 0.87 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4013999 0.86 NR1H2 (0.78) NR1H2NR1H3
SCHEMBL4010757 0.85 NR1H2 (0.80) NR1H2NR1H3
SCHEMBL4018336 0.85 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4013651 0.85 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4011456 0.85 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL35145 0.83 NR1H2 (0.63) NR1H2NR1H3
SCHEMBL4018760 0.83 NR1H2 (0.80) NR1H2NR1H3
SCHEMBL4013296 0.82 NR1H2 (0.81) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074098-A2 QUINOLINE COMPOUNDS Wyeth (US) 2009-07-01 EP claimed
WO-2008049047-A2 QUINOLINE COMPOUNDS WYETH (US) 2008-04-24 WO claimed