SCHEMBL15313887

SCHEMBL15313887

CC(C)c1ccccc1Cc1cc(C(=O)Nc2ccc3c(c2)S(=O)(=O)c2ccccc2-3)c(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.56
BCL2L1 Q07817 2/20 0.56
MCL1 Q07820 1/20 0.56
SIRT5 Q9NXA8 1/20 0.56
MAOA P21397 2/20 0.45
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 1/20 0.38
KCNK3 O14649 2/20 0.38
KCNK9 Q9NPC2 2/20 0.38
ABCC9 O60706 1/20 0.37
ABCC8 Q09428 1/20 0.37
KCNJ11 Q14654 1/20 0.37
KCNJ8 Q15842 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL15313899 0.84 BCL2 (0.67) BCL2BCL2L1MAOAKMT2AALDH1A1
SCHEMBL15313814 0.82 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5KMT2A
SCHEMBL15313816 0.78 BCL2 (0.58) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313849 0.76 BCL2 (0.67) BCL2BCL2L1MCL1SIRT5ALDH1A1
SCHEMBL15313828 0.74 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5ALDH1A1
SCHEMBL15313842 0.74 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5KMT2A
SCHEMBL15313898 0.73 MAOA (0.46) MAOAKMT2AALDH1A1MEN1MAPT
SCHEMBL15313823 0.72 BCL2 (0.72) BCL2BCL2L1MCL1SIRT5MAPT
SCHEMBL687266 0.72 BCL2 (1.00) BCL2BCL2L1MCL1SIRT5ALDH1A1
SCHEMBL29359532 0.72 BCL2 (1.00) BCL2BCL2L1MCL1SIRT5ALDH1A1

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