SCHEMBL19635774

SCHEMBL19635774

CCc1c2c(nn1CCN1CCOCC1)COCCCCn1c(C)c(CCCOc3cccc4ccccc34)c3cccc-2c31

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BAD Q92934 6/20 0.56
BCL2 P10415 4/20 0.56
MCL1 Q07820 15/20 0.56
BCL2L1 Q07817 4/20 0.56
PMAIP1 Q13794 6/20 0.55
ALB P02768 1/20 0.51

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
SCHEMBL19615162 0.91 MCL1 (0.69) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL19635216 0.90 BAD (0.61) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL24378272 0.86 BAD (0.56) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL24378233 0.86 BAD (0.56) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL19615159 0.85 MCL1 (0.70) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL19634934 0.85 BAD (0.62) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL19635463 0.83 MCL1 (0.60) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL24378195 0.83 MCL1 (0.62) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL24378276 0.83 MCL1 (0.57) BADBCL2MCL1BCL2L1PMAIP1
SCHEMBL19615118 0.83 MCL1 (0.73) BADBCL2MCL1BCL2L1PMAIP1

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