SCHEMBL4018323

SCHEMBL4018323

COc1ccc(-c2cccc(-c3c(C)cnc4c(C(F)(F)F)cccc34)c2)cc1S(C)(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 1.00
NR1H3 Q13133 17/20 0.80

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
SCHEMBL4016627 0.89 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4012284 0.89 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4016938 0.86 NR1H2 (0.83) NR1H2NR1H3
SCHEMBL4020025 0.83 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4014421 0.82 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4011510 0.82 NR1H2 (0.76) NR1H2NR1H3
SCHEMBL4019155 0.81 NR1H2 (0.81) NR1H2NR1H3
SCHEMBL4015489 0.80 NR1H3 (1.00) NR1H2NR1H3
SCHEMBL4012479 0.79 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4011431 0.79 NR1H2 (0.92) 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