SCHEMBL5517039

SCHEMBL5517039

NNC(=O)/C1=C/CCCCCC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 7/20 0.66
HDAC4 P56524 2/20 0.66
HDAC8 Q9BY41 2/20 0.66
HDAC6 Q9UBN7 2/20 0.66
CTSK P43235 1/20 0.57
HDAC1 Q13547 6/20 0.57
HDAC3 O15379 5/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
CCR2 P41597 1/20 0.44
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
SIRT3 Q9NTG7 1/20 0.36

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
SCHEMBL5517044 1.00 HDAC2 (0.66) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL5513200 1.00 HDAC2 (0.66) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL5521547 0.98 HDAC2 (0.68) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL5515923 0.92
SCHEMBL5479808 0.82 HDAC2 (0.96) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL10986673 0.80 HDAC2 (0.66) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL14880140 0.79 HDAC2 (1.00) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL6959836 0.78 HDAC2 (0.68) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL6959845 0.78 HDAC2 (0.68) HDAC2HDAC4HDAC8HDAC6CTSK
SCHEMBL13753921 0.77 CTSK (0.68) HDAC2HDAC4HDAC8HDAC6CTSK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1674526-B9 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2013-05-29 EP disclosed
EP-1674526-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-12-05 EP disclosed
US-20070032605-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-02-08 US disclosed
EP-1674526-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-06-28 EP disclosed