SCHEMBL25774207

SCHEMBL25774207

CCC(=O)NCC(=O)NC(CCCNC(N)=O)C(=O)Nc1ccc(COC(C)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 15/20 0.46
SIRT1 Q96EB6 14/20 0.46
SIRT3 Q9NTG7 5/20 0.44
SIRT5 Q9NXA8 3/20 0.42
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL24253175 0.88 SIRT2 (0.41) SIRT2SIRT1SIRT3SIRT5
SCHEMBL18937738 0.87 SIRT2 (0.40) SIRT2SIRT1SIRT3SIRT5
SCHEMBL23347054 0.87 SIRT2 (0.45) SIRT2SIRT1SIRT3SIRT5
SCHEMBL19485763 0.86 SIRT2 (0.44) SIRT2SIRT1SIRT3SIRT5
SCHEMBL16770337 0.86 SIRT2 (0.44) SIRT2SIRT1SIRT3SIRT5
SCHEMBL84114 0.86 SIRT2 (0.44) SIRT2SIRT1SIRT3SIRT5
SCHEMBL24180897 0.85 KMT2A (0.41) SIRT2SIRT1MEN1LMNAKMT2A
SCHEMBL14887423 0.85 FURIN (0.41) SIRT2SIRT1SIRT3SIRT5
SCHEMBL17236059 0.85 FURIN (0.41) SIRT2SIRT1SIRT3SIRT5
SCHEMBL25100584 0.85 SIRT2 (0.43) SIRT2SIRT1SIRT3SIRT5MEN1

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-2023124537-A1 CONJUGATE AND ANTIBODY-DRUG CONJUGATE PREPARED USING SAME 辽宁键凯科技有限公司 2023-07-06 WO disclosed