SCHEMBL15313814

SCHEMBL15313814

CC(C)c1ccccc1Cc1cc(C(=O)Nc2ccccc2)c(O)c(O)c1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 6/20 0.68
BCL2L1 Q07817 2/20 0.67
MCL1 Q07820 2/20 0.67
SIRT5 Q9NXA8 1/20 0.67
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
GAA P10253 1/20 0.47
KCNK3 O14649 3/20 0.45
KCNK9 Q9NPC2 3/20 0.45
HSPD1 P10809 1/20 0.44
HSPE1 P61604 1/20 0.44
BCAT2 O15382 1/20 0.44
ALDH1A1 P00352 1/20 0.42
ADRB2 P07550 1/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL15313849 0.88 BCL2 (0.67) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313816 0.87 BCL2 (0.58) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313828 0.84 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313842 0.84 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313841 0.83 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313827 0.83 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5HTT
SCHEMBL15313887 0.82 BCL2 (0.56) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL687266 0.81 BCL2 (1.00) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313823 0.81 BCL2 (0.72) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL29359532 0.81 BCL2 (1.00) BCL2BCL2L1MCL1SIRT5LMNA

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