SCHEMBL4013048

SCHEMBL4013048

Cc1cnc2c(Cl)cccc2c1-c1cccc(Oc2cccc(S(=O)(=O)N3CCNCC3)c2)c1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.72
NR1H3 Q13133 20/20 0.72

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
SCHEMBL4013505 0.91 NR1H2 (0.74) NR1H2NR1H3
SCHEMBL4013475 0.90 NR1H2 (0.73) NR1H2NR1H3
SCHEMBL4011589 0.89 NR1H2 (0.72) NR1H2NR1H3
SCHEMBL4013152 0.87 NR1H2 (0.68) NR1H2NR1H3
SCHEMBL4010669 0.85 NR1H2 (0.68) NR1H2NR1H3
SCHEMBL4012525 0.84 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4013131 0.83 NR1H2 (0.68) NR1H2NR1H3
SCHEMBL4018592 0.81 NR1H2 (0.80) NR1H2NR1H3
SCHEMBL4013674 0.81 NR1H2 (0.80) NR1H2NR1H3
SCHEMBL4012463 0.79 NR1H2 (0.75) 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 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