SCHEMBL29119136

SCHEMBL29119136

CC(C)(C)OC(=O)NCC(=O)NCCCCC(NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.59
SIRT1 Q96EB6 2/20 0.59
FOLH1 Q04609 2/20 0.57
KLK7 P49862 2/20 0.56
KLK5 Q9Y337 2/20 0.56
TGM2 P21980 5/20 0.56
MAPT P10636 1/20 0.55
SYK P43405 1/20 0.54
ITGB3 P05106 1/20 0.53
ITGAV P06756 1/20 0.53

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
SCHEMBL29119131 1.00 SIRT2 (0.59) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL15966648 0.93 SIRT2 (0.59) SIRT2SIRT1KLK7KLK5MAPT
SCHEMBL15966647 0.93 SIRT2 (0.59) SIRT2SIRT1KLK7KLK5MAPT
SCHEMBL17882092 0.93 SYK (0.57) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL1491720 0.93 FOLH1 (0.65) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL699636 0.93 FOLH1 (0.65) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL2467817 0.93 FOLH1 (0.65) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL15966718 0.92 FOLH1 (0.62) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL9051618 0.92 FOLH1 (0.62) SIRT2SIRT1FOLH1KLK7KLK5
SCHEMBL5328146 0.92 SIRT2 (0.66) SIRT2SIRT1FOLH1KLK7KLK5

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
CN-116887841-A Nanomaterials comprising ester-linked acetals 比姆医疗股份有限公司 2023-10-13 CN disclosed