SCHEMBL15975504

SCHEMBL15975504

[3H]CBCOC(=O)NCCCCC(NC(=O)OCBC[3H])C(=O)NC(CCCCNC(=O)OCBC[3H])C(=O)NC(CCCCNC(=O)OCBC[3H])C(=O)NCCOCCOCCOCCOCCCC(OCC)OCC

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.37
▸ TLR2 O60603 4/20 0.33
▸ TGM2 P21980 1/20 0.33
▸ SIRT1 Q96EB6 4/20 0.32
▸ SIRT6 Q8N6T7 1/20 0.32
▸ SIRT2 Q8IXJ6 5/20 0.32
▸ SIRT3 Q9NTG7 2/20 0.32

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
SCHEMBL15975507 0.87 GLP1R (0.40) GLP1RTLR2TGM2SIRT1SIRT6
SCHEMBL16216473 0.84 GLP1R (0.41) GLP1RTLR2TGM2SIRT1SIRT6
SCHEMBL14942519 0.79 SIRT6 (0.47) GLP1RTLR2SIRT1SIRT6
SCHEMBL837024 0.73 GLP1R (0.42) GLP1RTLR2SIRT1SIRT6SIRT2
SCHEMBL10310588 0.72 GLP1R (0.41) GLP1RTLR2TGM2SIRT1SIRT6
SCHEMBL10167191 0.71 SIRT1 (0.43) SIRT1SIRT6SIRT2SIRT3
SCHEMBL26346477 0.70 GLP1R (0.46) GLP1RTLR2SIRT1SIRT6SIRT2
SCHEMBL12410205 0.68 SIRT1 (0.49) SIRT1SIRT6SIRT2SIRT3
SCHEMBL15975505 0.67 TGM2 (0.48) TGM2SIRT1SIRT2SIRT3
SCHEMBL14642690 0.67 SIRT2 (0.61) TLR2SIRT1SIRT2SIRT3

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-8815227-B2 Hydroxyapatite-targeting multiarm polymers and conjugates made therefrom NEKTAR THERAPEUTICS (US) 2014-08-26 — — US disclosed
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