SCHEMBL19851674

SCHEMBL19851674

CCCCCCCC/C=C\CCCCCCCCNC(=O)[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 20/20 0.61
SIRT1 Q96EB6 16/20 0.61
SIRT3 Q9NTG7 13/20 0.61

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
SCHEMBL19851505 0.95 SIRT2 (0.67) SIRT2SIRT1SIRT3
SCHEMBL20542807 0.91 SIRT2 (0.65) SIRT2SIRT1SIRT3
SCHEMBL20542949 0.91 SIRT2 (0.65) SIRT2SIRT1SIRT3
SCHEMBL20542810 0.91 SIRT2 (0.65) SIRT2SIRT1SIRT3
SCHEMBL20542951 0.91 SIRT2 (0.65) SIRT2SIRT1SIRT3
SCHEMBL20543102 0.91 SIRT2 (0.65) SIRT2SIRT1SIRT3
SCHEMBL12148814 0.90 MAPT (0.62) SIRT2SIRT1SIRT3
SCHEMBL20543025 0.89 SIRT2 (0.62) SIRT2SIRT1SIRT3
SCHEMBL20543022 0.89 SIRT2 (0.62) SIRT2SIRT1SIRT3
SCHEMBL19851672 0.88 SIRT2 (0.77) SIRT2SIRT1SIRT3

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
WO-2018026866-A1 LIPID-SUBSTITUTED AMINO 1,2-AND 1,3-DIOL COMPOUNDS AS MODULATORS OF TLR2 DIMERIZATION NEUROPORE THERAPIES, INC. (US) 2018-02-08 WO disclosed