SCHEMBL15440259

SCHEMBL15440259

CC(=O)CC(=O)CC(C)=NN1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
NPC1 O15118 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
ALDH1A1 P00352 3/20 0.33
RAB9A P51151 3/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
MAPT P10636 4/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL15440257 1.00 HTT (0.39) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15440027 0.90 HTT (0.48) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15440029 0.90 HTT (0.48) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15438971 0.85 SMN1; SMN2 (0.33) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15438969 0.85 SMN1; SMN2 (0.33) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15438818 0.83 HTT (0.38) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15438820 0.83 HTT (0.38) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL11873789 0.77 GAA (0.41) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL11873794 0.77 GAA (0.41) HTTNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL15439598 0.76 ALDH1A1 (0.42) HTTNPC1SMN1; SMN2ALDH1A1RAB9A

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