SCHEMBL4761500

SCHEMBL4761500

CC(=O)NCCCCC(NC(C)=O)C(=O)NCN1C(=O)C=CC1=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.48
▸ SIRT1 Q96EB6 1/20 0.48
▸ SIRT5 Q9NXA8 3/20 0.44
▸ FOLH1 Q04609 1/20 0.41
▸ CA1 P00915 7/20 0.40
▸ CA2 P00918 7/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALB P02768 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ GRIA1 P42261 1/20 0.37
▸ HDAC1 Q13547 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL13025173 0.87 SIRT5 (0.41) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL12721098 0.83 SIRT6 (0.46) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL12910864 0.83 SIRT5 (0.42) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL13499241 0.83 SIRT5 (0.43) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL14016183 0.82 AKT1 (0.40) SIRT6SIRT1CA1CA2
SCHEMBL10147950 0.82 KDM4E (0.38) FOLH1KDM4EMAPK1HIF1A
SCHEMBL19546723 0.75 SIRT6 (0.69) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL21303704 0.74 SIRT1 (0.56) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL4567600 0.74 SIRT1 (0.56) SIRT6SIRT1SIRT5FOLH1CA1
SCHEMBL19681219 0.74 SIRT6 (0.72) SIRT6SIRT1SIRT5FOLH1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120123065-A1 Hydrolytically Stable Maleimide-Terminated Polymers NEKTAR THERAPEUTICS (US) 2012-05-17 — — US disclosed
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