SCHEMBL30001413

SCHEMBL30001413

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc(Br)c2n1CCN1CCOCC1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 15/20 0.66
ALB P02768 2/20 0.66
BCL2 P10415 5/20 0.49
BCL2L1 Q07817 1/20 0.49
BAD Q92934 2/20 0.48
POLB P06746 1/20 0.48
PMAIP1 Q13794 1/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 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
SCHEMBL4154074 1.00 MCL1 (0.66) MCL1ALBBCL2BCL2L1BAD
SCHEMBL4165032 0.89 MCL1 (0.52) MCL1ALBBCL2BCL2L1BAD
SCHEMBL4159851 0.87 MCL1 (0.52) MCL1ALBBCL2BCL2L1POLB
SCHEMBL24745244 0.84 MCL1 (0.57) MCL1
SCHEMBL4175366 0.84 MCL1 (0.49) MCL1ALBBCL2BCL2L1BAD
SCHEMBL30000916 0.84 MCL1 (0.67) MCL1ALBBCL2BCL2L1BAD
SCHEMBL24745257 0.84 MCL1 (0.67) MCL1ALBBCL2BCL2L1BAD
SCHEMBL4173496 0.82 MCL1 (0.48) MCL1ALBBCL2BCL2L1BAD
SCHEMBL4170698 0.79 MCL1 (1.00) MCL1ALBBCL2BCL2L1PMAIP1
SCHEMBL4170176 0.79 MCL1 (0.54) MCL1ALBBCL2BCL2L1BAD

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
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-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