SCHEMBL15440276

SCHEMBL15440276

CC(=O)CCC(C)=NN(C)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KMT2A Q03164 4/20 0.45
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
HPGD P15428 1/20 0.43
G6PC1 P35575 1/20 0.42
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 1/20 0.40
RIPK1 Q13546 1/20 0.40
AOC3 Q16853 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL15440275 1.00 NPC1 (0.49) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15440184 0.86 KMT2A (0.49) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15440186 0.86 KMT2A (0.49) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15439845 0.85 G6PC1 (0.56) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15439846 0.85 G6PC1 (0.56) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15438589 0.85 NPC1 (0.50) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15438590 0.85 NPC1 (0.50) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15439098 0.83 G6PC1 (0.46) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15439096 0.83 G6PC1 (0.46) NPC1RAB9AALDH1A1KMT2ACA12
SCHEMBL15439428 0.81 ALDH1A1 (0.46) NPC1RAB9AALDH1A1KMT2ACA12

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