SCHEMBL15313857

SCHEMBL15313857

O=C(Nc1ccc(S(=O)(=O)c2ccccn2)cc1)c1cc(Cc2cccc3ccccc23)c(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 3/20 0.56
BCL2L1 Q07817 2/20 0.54
MCL1 Q07820 1/20 0.50
SIRT5 Q9NXA8 1/20 0.50
NAMPT P43490 3/20 0.46
ABCC9 O60706 1/20 0.43
ABCC8 Q09428 1/20 0.43
KCNJ11 Q14654 1/20 0.43
KCNJ8 Q15842 1/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
PLG P00747 2/20 0.40
KLK1 P06870 2/20 0.40
KLK6 Q92876 2/20 0.40
DPP4 P27487 1/20 0.40
DEGS1 O15121 1/20 0.39
MEN1 O00255 2/20 0.39
POLB P06746 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL15313853 0.86 BCL2 (0.77) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313860 0.86 BCL2L1 (0.67) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313861 0.85 BCL2 (0.63) BCL2BCL2L1MCL1SIRT5NPC1
SCHEMBL15313843 0.81 BCL2L1 (0.83) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313846 0.76 BCL2 (0.57) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313848 0.74 BCL2L1 (0.56) BCL2BCL2L1MCL1SIRT5RAB9A
SCHEMBL15313870 0.73 BCL2 (0.52) BCL2BCL2L1MCL1SIRT5MEN1
SCHEMBL15313820 0.73 BCL2 (1.00) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313858 0.73 BCL2 (0.56) BCL2BCL2L1MCL1SIRT5NAMPT
SCHEMBL15313859 0.72 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5NAMPT

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