SCHEMBL4043308

SCHEMBL4043308

CC(=O)NC(C)c1cc(Cl)c2cccnc2c1OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.64
NPC1 O15118 9/20 0.56
RAB9A P51151 9/20 0.56
ALOX12 P18054 5/20 0.56
NCOA3 Q9Y6Q9 2/20 0.56
HSP90AA1 P07900 2/20 0.56
ADAMTS5 Q9UNA0 5/20 0.51
NCOA1 Q15788 1/20 0.50
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
HIF1A Q16665 1/20 0.48
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL4037188 0.82 HIF1A (0.45) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL4038202 0.79 ADAMTS5 (0.43) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL4037903 0.79 L3MBTL1 (1.00) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL3822384 0.77 HIF1A (0.64) L3MBTL1NPC1RAB9AALOX12HSP90AA1
SCHEMBL12622768 0.76 HIF1A (0.46) L3MBTL1NPC1RAB9AALOX12HSP90AA1
SCHEMBL4037863 0.76 L3MBTL1 (0.69) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL12622766 0.74 HIF1A (0.44) L3MBTL1NPC1RAB9AALOX12ADAMTS5
SCHEMBL3976222 0.73 ADAMTS5 (0.41) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL2598259 0.72 NPC1 (1.00) L3MBTL1NPC1RAB9AALOX12NCOA3
SCHEMBL1811084 0.72 HIF1A (0.49) L3MBTL1NPC1RAB9AALOX12HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 EP disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed