SCHEMBL15313846

SCHEMBL15313846

CC(C)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2cc(Cc3cccc4ccccc34)c(O)c(O)c2O)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.57
BCL2L1 Q07817 2/20 0.57
MCL1 Q07820 2/20 0.57
SIRT5 Q9NXA8 1/20 0.57
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
ALOX12 P18054 3/20 0.44
ALDH1A1 P00352 2/20 0.44
GPR27 Q9NS67 2/20 0.41
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
GHSR Q92847 1/20 0.40
NAMPT P43490 1/20 0.40

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
SCHEMBL15313842 0.91 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313838 0.87 BCL2 (0.66) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313827 0.81 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5HTT
SCHEMBL15313841 0.81 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5KMT2A
SCHEMBL15313861 0.80 BCL2 (0.63) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313850 0.80 BCL2 (0.56) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313860 0.79 BCL2L1 (0.67) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313835 0.79 CA12 (0.51) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313843 0.77 BCL2L1 (0.83) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313911 0.77 BCL2 (0.53) BCL2BCL2L1MCL1SIRT5MEN1

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
US-8557812-B2 Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-10-15 US disclosed
US-8557812-B2 Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-10-15 US disclosed