SCHEMBL15440236

SCHEMBL15440236

CCC/C(=N\N(C)Cc1ccccc1)C(C)=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KMT2A Q03164 4/20 0.43
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 1/20 0.41
RIPK1 Q13546 2/20 0.41
G6PC1 P35575 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
MEN1 O00255 2/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL15440237 1.00 NPC1 (0.46) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440073 0.88 NPC1 (0.45) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440071 0.88 NPC1 (0.45) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440334 0.86 G6PC1 (0.53) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440332 0.86 G6PC1 (0.53) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440308 0.82 RAB9A (0.41) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15440310 0.82 RAB9A (0.41) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15439176 0.82 NPC1 (0.46) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15439177 0.82 NPC1 (0.46) NPC1RAB9AKMT2ACA12CA9
SCHEMBL15439347 0.81 NPC1 (0.40) NPC1RAB9AKMT2ACA12CA9

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