SCHEMBL19635334

SCHEMBL19635334

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3c2n1CCCN(C)Cc1[nH]nc(COC)c1-3

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 18/20 0.51
PMAIP1 Q13794 11/20 0.51
BAD Q92934 5/20 0.51
BCL2L1 Q07817 5/20 0.51
BCL2 P10415 5/20 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
SCHEMBL19634906 0.95 MCL1 (0.52) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635133 0.93 MCL1 (0.52) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635985 0.93 MCL1 (0.60) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19636006 0.91 MCL1 (0.60) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635336 0.89 MCL1 (0.48) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635848 0.88 MCL1 (0.48) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635335 0.87 MCL1 (0.55) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635519 0.86 BAD (0.56) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19635211 0.85 MCL1 (0.51) MCL1PMAIP1BADBCL2L1BCL2
SCHEMBL19634929 0.83 MCL1 (0.60) MCL1PMAIP1BADBCL2L1BCL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 WO disclosed