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SCHEMBL19635086

SCHEMBL19635086

CCOC(=O)c1c(CCCOc2cccc3ccccc23)c2cccc3c2n1CCCCOCc1[nH]nc(COc2ccc(C4(O)CCOCC4)cc2)c1-3

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 16/20 0.49
▸ BAD Q92934 6/20 0.46
▸ BCL2 P10415 3/20 0.46
▸ BCL2L1 Q07817 5/20 0.46
▸ PMAIP1 Q13794 5/20 0.43
▸ ALB P02768 1/20 0.41

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
SCHEMBL19635741 0.93 MCL1 (0.52) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635823 0.92 MCL1 (0.53) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635089 0.89 MCL1 (0.58) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635610 0.87 MCL1 (0.51) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635457 0.87 MCL1 (0.53) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635180 0.86 MCL1 (0.52) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635275 0.86 MCL1 (0.47) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635607 0.86 BAD (0.57) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19635000 0.85 MCL1 (0.53) MCL1BADBCL2BCL2L1PMAIP1
SCHEMBL19634882 0.83 MCL1 (0.41) MCL1BADBCL2BCL2L1PMAIP1

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