SCHEMBL15313808

SCHEMBL15313808

CC(C)CCCc1ccccc1Cc1cc(C(=O)Nc2ccc(S(=O)(=O)c3ccccc3C(C)(C)C)cc2)c(O)c(O)c1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 3/20 0.77
BCL2 P10415 5/20 0.76
MCL1 Q07820 1/20 0.76
SIRT5 Q9NXA8 1/20 0.76
NAMPT P43490 3/20 0.35
HSD11B1 P28845 1/20 0.34
ALB P02768 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
MMP14 P50281 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
KCNJ8 Q15842 1/20 0.34
LMNA P02545 3/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL687266 0.86 BCL2 (1.00) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL29359532 0.86 BCL2 (1.00) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL29360605 0.86 BCL2 (1.00) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL15313895 0.83 BCL2L1 (0.84) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL15313843 0.83 BCL2L1 (0.83) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL15313807 0.81 BCL2L1 (0.79) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL22781207 0.80 BCL2 (0.87) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL15313856 0.79 BCL2L1 (0.77) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL15313804 0.78 BCL2L1 (0.72) BCL2L1BCL2MCL1SIRT5NAMPT
SCHEMBL20153703 0.78 BCL2 (0.84) BCL2L1BCL2MCL1SIRT5NAMPT

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