SCHEMBL29055304

SCHEMBL29055304

CCCCCCCCCCCCCC(=O)NCCCCC(NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 19/20 0.81
SIRT1 Q96EB6 14/20 0.81
SIRT3 Q9NTG7 11/20 0.71
FOLH1 Q04609 1/20 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
SCHEMBL29055302 1.00 SIRT2 (0.81) SIRT2SIRT1SIRT3FOLH1
SCHEMBL19253993 0.92 SIRT2 (0.75) SIRT2SIRT1SIRT3FOLH1
SCHEMBL2963543 0.89 SIRT2 (0.76) SIRT2SIRT1SIRT3FOLH1
SCHEMBL7689520 0.89 SIRT2 (0.76) SIRT2SIRT1SIRT3FOLH1
SCHEMBL21357647 0.89 SIRT2 (0.76) SIRT2SIRT1SIRT3FOLH1
SCHEMBL4787188 0.89 SIRT2 (0.76) SIRT2SIRT1SIRT3FOLH1
SCHEMBL25887999 0.88 SIRT2 (0.67) SIRT2SIRT1SIRT3FOLH1
SCHEMBL6199045 0.88 SIRT2 (0.65) SIRT2SIRT1SIRT3FOLH1
SCHEMBL17279329 0.88 SIRT2 (0.74) SIRT2SIRT1SIRT3FOLH1
SCHEMBL11308449 0.88 SIRT2 (0.74) SIRT2SIRT1SIRT3FOLH1

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-116178340-B PROTAC compound, preparation method and pharmaceutical composition 细胞生态海河实验室 2023-08-18 CN claimed