SCHEMBL15439803

SCHEMBL15439803

CC(=O)CC(Cc1ccccc1)=NN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PC1 P35575 1/20 0.53
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
REN P00797 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
LMNA P02545 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
AKR1B1 P15121 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL15439802 1.00 G6PC1 (0.53) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15440543 0.88 G6PC1 (0.53) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15440544 0.88 G6PC1 (0.53) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15438710 0.86 NPC1 (0.46) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15438708 0.86 NPC1 (0.46) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15439252 0.86 G6PC1 (0.51) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15439251 0.86 G6PC1 (0.51) G6PC1NPC1RAB9ACA12CA9
SCHEMBL15439261 0.84 CES2 (0.42) NPC1RAB9ABCHEACHEMEN1
SCHEMBL15439258 0.84 CES2 (0.42) NPC1RAB9ABCHEACHEMEN1
SCHEMBL15439166 0.84 NPC1 (0.41) G6PC1NPC1RAB9ACA12CA9

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
US-9115231-B2 Polymers functionalized with protected hydrazone compounds containing an acyl group BRIDGESTONE CORPORATION (JP) 2015-08-25 US disclosed
US-20140031488-A1 Polymers Functionalized With Protected Hydrazone Compounds Containing An Acyl Group BRIDGESTONE CORPORATION (JP) 2014-01-30 US disclosed