SCHEMBL4010226

SCHEMBL4010226

Cc1cc(-c2cc(-c3cccc(S(C)(=O)=O)c3)ccc2Cl)c2cccc(C(F)(F)F)c2n1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 18/20 0.57
NR1H3 Q13133 17/20 0.57
RXRA P19793 4/20 0.50

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
SCHEMBL4012475 0.89 NR1H2 (0.58) NR1H2NR1H3RXRA
SCHEMBL4017313 0.87 NR1H2 (0.70) NR1H2NR1H3RXRA
SCHEMBL4017110 0.85 NR1H2 (0.57) NR1H2NR1H3RXRA
SCHEMBL4014198 0.81 NR1H3 (0.47) NR1H2NR1H3RXRA
SCHEMBL3506329 0.80 NR1H2 (0.60) NR1H2NR1H3RXRA
SCHEMBL4011954 0.78 NR1H2 (0.73) NR1H2NR1H3RXRA
SCHEMBL4018710 0.78 NR1H2 (0.55) NR1H2NR1H3RXRA
SCHEMBL4012176 0.78 NR1H2 (0.46) NR1H2NR1H3RXRA
SCHEMBL4010841 0.77 RORC (0.40) NR1H2NR1H3RXRA
SCHEMBL4012143 0.77 ESR1 (0.40)

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