SCHEMBL4017772

SCHEMBL4017772

CS(=O)(=O)c1cccc(Oc2ccc(Cl)c(-c3ccnc4c(F)cccc34)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 0.65
NR1H3 Q13133 19/20 0.65
RXRA P19793 1/20 0.57

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
SCHEMBL4020515 0.91 NR1H2 (0.78) NR1H2NR1H3RXRA
SCHEMBL4011996 0.89 NR1H2 (0.66) NR1H2NR1H3RXRA
SCHEMBL4012025 0.88 NR1H2 (0.75) NR1H2NR1H3RXRA
SCHEMBL4011491 0.87 NR1H2 (0.64) NR1H2NR1H3RXRA
SCHEMBL4015117 0.85 NR1H2 (0.62) NR1H2NR1H3RXRA
SCHEMBL4018341 0.85 NR1H2 (0.77) NR1H2NR1H3RXRA
SCHEMBL4012484 0.84 NR1H2 (0.60) NR1H2NR1H3RXRA
SCHEMBL4011973 0.82 NR1H2 (0.58) NR1H2NR1H3RXRA
SCHEMBL4018729 0.82 NR1H2 (0.53) NR1H2NR1H3RXRA
SCHEMBL4012778 0.81 NR1H2 (0.56) NR1H2NR1H3RXRA

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