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SCHEMBL4018307

SCHEMBL4018307

CS(=O)(=O)c1cccc(Oc2cccc(-c3c(Cc4ccccc4)cnc4c(Cl)cccc34)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 20/20 1.00
▸ NR1H3 Q13133 20/20 1.00
▸ PPARG P37231 1/20 0.51
▸ PPARD Q03181 1/20 0.51
▸ PPARA Q07869 1/20 0.51

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
SCHEMBL4013026 0.87 NR1H2 (1.00) NR1H2NR1H3PPARG
SCHEMBL1125366 0.85 NR1H2 (0.73) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL4012525 0.83 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL4263687 0.83 NR1H2 (0.71) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125281 0.83 NR1H2 (0.70) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL4013488 0.82 NR1H2 (0.84) NR1H2NR1H3
SCHEMBL1125878 0.82 NR1H2 (0.78) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL4015540 0.82 NR1H2 (0.78) NR1H2NR1H3
SCHEMBL1125707 0.81 NR1H2 (0.68) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL4012610 0.81 NR1H2 (0.88) NR1H2NR1H3PPARGPPARDPPARA

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