SCHEMBL6322708

SCHEMBL6322708

CCCCCc1ccc(C(=O)COc2ccc(Cl)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRA P10827 4/20 0.57
THRB P10828 4/20 0.57
PLA2G4A P47712 4/20 0.56
PPARA Q07869 1/20 0.54
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
HAO1 Q9UJM8 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
RAB9A P51151 1/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49

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
SCHEMBL6323761 0.96 L3MBTL1 (0.52) THRATHRBPLA2G4APPARAKDM4E
SCHEMBL6322900 0.82 L3MBTL1 (0.63) THRATHRBPLA2G4ALMNAMAPT
SCHEMBL6325847 0.82 MAPT (0.64) KDM4ELMNAMAPTL3MBTL1RAB9A
SCHEMBL1284112 0.82 L3MBTL1 (0.59) THRATHRBL3MBTL1
SCHEMBL6202777 0.81 MAPT (0.64) KDM4ELMNAMAPTL3MBTL1RAB9A
SCHEMBL29430540 0.81 THRB (0.57) THRATHRBPPARAKDM4ELMNA
SCHEMBL1283890 0.80 L3MBTL1 (0.61) THRATHRBPPARALMNAMAPT
SCHEMBL12611881 0.80 PLA2G4A (0.56) THRATHRBPLA2G4ALMNAMEN1
SCHEMBL11001416 0.80 PPARA (0.58) THRATHRBPPARALMNAMAPT
SCHEMBL29430571 0.80 PPARA (0.58) THRATHRBPPARALMNAMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050272036-A1 Ketones ASTRAZENECA AB (SE) 2005-12-08 US disclosed