SCHEMBL4013158

SCHEMBL4013158

N#Cc1cnc2c(C(F)(F)F)cccc2c1-c1cccc(-c2cccc(S(=O)(=O)CC(=O)O)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.62
NR1H3 Q13133 19/20 0.62

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
SCHEMBL4010985 0.91 NR1H2 (0.74) NR1H2NR1H3
SCHEMBL4018760 0.86 NR1H2 (0.80) NR1H2NR1H3
SCHEMBL4017669 0.84 NR1H2 (0.65) NR1H2NR1H3
SCHEMBL4011440 0.82 NR1H2 (0.74) NR1H2NR1H3
SCHEMBL4010593 0.81 NR1H2 (0.83) NR1H2NR1H3
Methane SCHEMBL4013263 0.80 NR1H2 (0.60) NR1H2NR1H3
SCHEMBL4011068 0.79 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL4012887 0.78 NR1H2 (0.62) NR1H2NR1H3
SCHEMBL4013028 0.78 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL4013226 0.78 NR1H2 (0.73) 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