SCHEMBL24745191

SCHEMBL24745191

Cc1nn(C)c(C)c1-c1c(Cl)ccc2c(CCCOc3cccc4c3CCCC4)c(C(=O)OC(C)(C)C)[nH]c12

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.51
BCL2L1 Q07817 4/20 0.51
BCL2 P10415 3/20 0.51
EEF2K O00418 1/20 0.47
MARK3 P27448 1/20 0.47
AXL P30530 1/20 0.47
BCL6 P41182 1/20 0.47
NEK4 P51957 1/20 0.47
PRKCD Q05655 1/20 0.47
PRKAA1 Q13131 1/20 0.47
CAMK2B Q13554 1/20 0.47
CAMK2G Q13555 1/20 0.47
CAMK2D Q13557 1/20 0.47
MARK2 Q7KZI7 1/20 0.47
PIM3 Q86V86 1/20 0.47
HIPK2 Q9H2X6 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
MAP3K20 Q9NYL2 1/20 0.47
MAP4K5 Q9Y4K4 1/20 0.47

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
SCHEMBL30000771 1.00 MCL1 (0.51) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL24744664 0.91 MCL1 (0.52) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL30000277 0.91 MCL1 (0.52) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL30000899 0.91 MCL1 (0.61) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL24745275 0.91 MCL1 (0.61) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL24744627 0.86 MCL1 (0.64) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL30000684 0.86 MCL1 (0.64) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL24773673 0.85 MCL1 (0.53) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL24745112 0.84 MCL1 (0.55) MCL1BCL2L1BCL2EEF2KMARK3
SCHEMBL30000890 0.84 MCL1 (0.55) MCL1BCL2L1BCL2EEF2KMARK3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117957218-A Targeted protein degradation using bifunctional compounds that bind to ubiquitin ligases and target MCL-1 proteins 凯普托尔治疗学股份有限公司 2024-04-30 CN disclosed
WO-2022255888-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed
WO-2022253713-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed