SCHEMBL29131983

SCHEMBL29131983

COCCOCCOCCOCCNC(=O)C(N)CCC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ CA2 P00918 2/20 0.37
▸ TLR2 O60603 13/20 0.36
▸ DPP7 Q9UHL4 2/20 0.35

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
SCHEMBL26232048 1.00 PLK1 (0.42) PLK1MEN1KMT2ACA2TLR2
SCHEMBL31756841 1.00 PLK1 (0.42) PLK1MEN1KMT2ACA2TLR2
SCHEMBL19447825 0.92 PLK1 (0.39) PLK1MEN1KMT2ADPP7
SCHEMBL23417972 0.90 TLR2 (0.44) PLK1MEN1KMT2ACA2TLR2
SCHEMBL16757624 0.90 MEN1 (0.43) PLK1MEN1KMT2ACA2TLR2
SCHEMBL16791114 0.90 PLK1 (0.42) PLK1MEN1KMT2ACA2TLR2
SCHEMBL16757623 0.90 MEN1 (0.43) PLK1MEN1KMT2ACA2TLR2
SCHEMBL29467645 0.90 PLK1 (0.45) PLK1TLR2DPP7
SCHEMBL21836141 0.89 TLR2 (0.45) PLK1MEN1KMT2ACA2TLR2
SCHEMBL16757612 0.89 TLR2 (0.45) PLK1MEN1KMT2ACA2TLR2

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-117279662-A Branched linkers for antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2023-12-22 — — CN disclosed
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