SCHEMBL4017933

SCHEMBL4017933

CC(C)S(=O)(=O)c1cccc(Oc2ccc(Cl)c(-c3ccnc4c(C(F)(F)F)cccc34)c2)c1

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.76
NR1H3 Q13133 20/20 0.76
RXRA P19793 1/20 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
SCHEMBL4015359 0.94 NR1H2 (0.66) NR1H2NR1H3RXRA
SCHEMBL4012025 0.90 NR1H2 (0.75) NR1H2NR1H3RXRA
SCHEMBL4011525 0.88 NR1H2 (0.62) NR1H2NR1H3RXRA
SCHEMBL4014663 0.87 NR1H2 (1.00) NR1H2NR1H3RXRA
SCHEMBL4019268 0.86 NR1H2 (0.59) NR1H2NR1H3RXRA
SCHEMBL3507601 0.86 NR1H2 (0.61) NR1H2NR1H3RXRA
SCHEMBL4012216 0.86 NR1H2 (0.56) NR1H2NR1H3RXRA
SCHEMBL4013247 0.86 NR1H2 (0.56) NR1H2NR1H3RXRA
SCHEMBL4014008 0.85 NR1H2 (0.64) NR1H2NR1H3RXRA
SCHEMBL4012594 0.83 NR1H2 (0.61) 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 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