SCHEMBL1124694

SCHEMBL1124694

Cc1cc(CNc2cccc(-c3[c]cnc4c(C(F)(F)F)cccc34)c2)oc1C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.47
NR1H3 Q13133 19/20 0.47
PPARG P37231 1/20 0.41
PPARD Q03181 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL28759525 0.85 NR1H2 (0.42) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27653887 0.83 NR1H2 (0.49) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1125578 0.83 NR1H2 (0.65) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27653875 0.82 NR1H2 (0.58) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27674072 0.82 NR1H2 (0.43) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27653968 0.80 NR1H2 (0.46) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27653850 0.80 NR1H2 (0.53) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27673895 0.80 NR1H2 (0.59) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL27674035 0.80 NR1H2 (0.49) NR1H2NR1H3PPARGPPARDPPARA
SCHEMBL1124878 0.79 NR1H2 (0.41) 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
CN-1914173-A Quinolines useful in treating cardiovascular disease WYETH CORP (US) 2007-02-14 CN claimed
EP-2284157-A1 Quinolines useful in treating cardiovascular disease Wyeth (US) 2011-02-16 EP disclosed
EP-1692111-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE Wyeth, A Corporation of the State of Delaware (US) 2006-08-23 EP disclosed
WO-2005058834-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE WYETH (US) 2005-06-30 WO disclosed