SCHEMBL24744633

SCHEMBL24744633

Cc1cc(OCCCc2c(C(=O)O)n(CCN3CCN(CCCOCCOCCNc4cccc5c4C(=O)N(C4CCC(=O)NC4=O)C5=O)CC3)c3c(-c4c(C)nn(C)c4C)cccc23)cc(C)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 11/20 0.50
BCL2 P10415 3/20 0.48
BCL2L1 Q07817 3/20 0.48
ALB P02768 1/20 0.48
PTK2 Q05397 1/20 0.47
EGFR P00533 4/20 0.46
ERBB2 P04626 4/20 0.46
PDE6D O43924 2/20 0.46
AKT1 P31749 1/20 0.45
AKT2 P31751 1/20 0.45
AKT3 Q9Y243 1/20 0.45

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
SCHEMBL24745286 0.99 MCL1 (0.51) MCL1BCL2BCL2L1ALBPTK2
SCHEMBL24745339 0.97 MCL1 (0.51) MCL1BCL2BCL2L1ALBPTK2
SCHEMBL30001329 0.97 MCL1 (0.51) MCL1BCL2BCL2L1ALBPTK2
SCHEMBL24773807 0.96 MCL1 (0.47) MCL1BCL2BCL2L1ALBPTK2
SCHEMBL24744625 0.92 MCL1 (0.49) MCL1ALBPDE6D
SCHEMBL30000212 0.92 MCL1 (0.56) MCL1BCL2BCL2L1ALB
SCHEMBL24745152 0.92 MCL1 (0.56) MCL1BCL2BCL2L1ALB
SCHEMBL24773175 0.91 MCL1 (0.53) MCL1BCL2BCL2L1
SCHEMBL30001556 0.91 MCL1 (0.53) MCL1BCL2BCL2L1
SCHEMBL24745646 0.90 AKT1 (0.50) MCL1BCL2PDE6DAKT1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4347579-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN Captor Therapeutics S.A. (PL) 2024-04-10 EP 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-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
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