SCHEMBL4011028

SCHEMBL4011028

CCCS(=O)(=O)c1cc(Cl)cc(Oc2cccc(-c3c(C)cnc4c(C(F)(F)F)cccc34)c2)c1

nearest known ligand 0.85

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 20/20 0.85
NR1H2 P55055 19/20 0.85

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
SCHEMBL4012430 0.92 NR1H3 (1.00) NR1H3NR1H2
SCHEMBL4012457 0.91 NR1H3 (0.86) NR1H3NR1H2
SCHEMBL4015435 0.89 NR1H3 (1.00) NR1H3NR1H2
SCHEMBL4011615 0.87 NR1H3 (0.90) NR1H3NR1H2
SCHEMBL4012454 0.86 NR1H3 (1.00) NR1H3NR1H2
SCHEMBL3506071 0.85 NR1H2 (0.62) NR1H3NR1H2
SCHEMBL4011693 0.85 NR1H3 (0.84) NR1H3NR1H2
SCHEMBL4012070 0.83 NR1H2 (0.79) NR1H3NR1H2
SCHEMBL4012051 0.83 NR1H3 (0.84) NR1H3NR1H2
SCHEMBL4009503 0.83 NR1H2 (1.00) NR1H3NR1H2

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