SCHEMBL30000000

SCHEMBL30000000

Cc1n[nH]c(C)c1-c1cccc2c(CCCOc3cccc4ccccc34)c(C(=O)OC(C)(C)C)n(CCN3CCOCC3)c12

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 17/20 0.65
ALB P02768 2/20 0.65
BCL2 P10415 3/20 0.51
PMAIP1 Q13794 3/20 0.49
BAD Q92934 3/20 0.47
BCL2L1 Q07817 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
SCHEMBL24745273 1.00 MCL1 (0.65) MCL1ALBBCL2PMAIP1BAD
SCHEMBL24745257 0.92 MCL1 (0.67) MCL1ALBBCL2PMAIP1BAD
SCHEMBL30000916 0.92 MCL1 (0.67) MCL1ALBBCL2PMAIP1BAD
SCHEMBL30000898 0.91 MCL1 (0.78) MCL1ALBBCL2PMAIP1BAD
SCHEMBL24745258 0.91 MCL1 (0.78) MCL1ALBBCL2PMAIP1BAD
SCHEMBL24745169 0.86 MCL1 (0.61) MCL1BCL2BCL2L1
SCHEMBL30000751 0.86 MCL1 (0.61) MCL1BCL2BCL2L1
SCHEMBL24773111 0.84 MCL1 (0.59) MCL1ALBBCL2PMAIP1BAD
SCHEMBL24746693 0.83 MCL1 (0.72) MCL1ALBBCL2PMAIP1BAD
SCHEMBL24745228 0.83 MCL1 (0.66) MCL1ALBBCL2PMAIP1BAD

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-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