SCHEMBL19635575

SCHEMBL19635575

CCc1nn(C)c2c1-c1cccc3c(CCCBr)c(C=O)n(c13)CCCCOC2

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 16/20 0.48
BAD Q92934 4/20 0.44
BCL2L1 Q07817 3/20 0.44
BCL2 P10415 3/20 0.44

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
SCHEMBL24594219 0.87 MCL1 (0.59) MCL1BADBCL2L1BCL2
SCHEMBL19615342 0.87 MCL1 (0.63) MCL1BADBCL2L1BCL2
SCHEMBL19635951 0.85 MCL1 (0.47) MCL1BADBCL2L1BCL2
SCHEMBL19635574 0.85 MCL1 (0.55) MCL1BADBCL2L1BCL2
SCHEMBL24378130 0.85 MCL1 (0.47) MCL1BADBCL2L1BCL2
SCHEMBL19636011 0.84 MCL1 (0.66) MCL1BADBCL2L1BCL2
SCHEMBL19635078 0.79 MCL1 (0.56) MCL1BADBCL2L1BCL2
SCHEMBL24594089 0.79 MCL1 (0.57) MCL1BADBCL2L1
SCHEMBL24594152 0.79 MCL1 (0.60) MCL1BADBCL2L1BCL2
SCHEMBL19635422 0.79 MCL1 (0.56) MCL1BADBCL2L1BCL2

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-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 WO disclosed