SCHEMBL15438841

SCHEMBL15438841

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

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
RIPK1 Q13546 2/20 0.43
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 3/20 0.41
TSHR P16473 2/20 0.41
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
MAPK1 P28482 1/20 0.41
MEN1 O00255 1/20 0.41
HPGD P15428 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
SCHEMBL15438842 1.00 LMNA (0.47) LMNANPC1RAB9ACA12CA9
SCHEMBL15440071 0.87 NPC1 (0.45) LMNANPC1RAB9ACA12CA9
SCHEMBL15440073 0.87 NPC1 (0.45) LMNANPC1RAB9ACA12CA9
SCHEMBL15439552 0.85 G6PC1 (0.51) LMNANPC1RAB9ACA12CA9
SCHEMBL15439553 0.85 G6PC1 (0.51) LMNANPC1RAB9ACA12CA9
SCHEMBL15439349 0.84 NPC1 (0.45) LMNANPC1RAB9ACA12CA9
SCHEMBL15439351 0.84 NPC1 (0.45) LMNANPC1RAB9ACA12CA9
SCHEMBL15439878 0.81 NPC1 (0.42) LMNANPC1RAB9ACA12CA9
SCHEMBL15439879 0.81 NPC1 (0.42) LMNANPC1RAB9ACA12CA9
SCHEMBL15439066 0.81 LMNA (0.45) LMNANPC1RAB9ACA12CA9

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