SCHEMBL15313851

SCHEMBL15313851

CCc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1NC(=O)c1cc(Cc2ccccc2C(C)C)c(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 3/20 0.56
BCL2L1 Q07817 2/20 0.56
MCL1 Q07820 1/20 0.56
SIRT5 Q9NXA8 1/20 0.56
LMNA P02545 3/20 0.46
TDP1 Q9NUW8 1/20 0.44
IDH1 O75874 1/20 0.42
HTT P42858 2/20 0.42
GPR27 Q9NS67 5/20 0.41
MAPT P10636 3/20 0.40
AVPR2 P30518 2/20 0.40
TP53 P04637 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 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
SCHEMBL15313845 0.92 BCL2 (0.58) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313852 0.90 BCL2 (0.59) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313850 0.89 BCL2 (0.56) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313801 0.82 BCL2L1 (0.60) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313842 0.81 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313844 0.80 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313827 0.78 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5HTT
SCHEMBL15313841 0.78 BCL2 (0.64) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313828 0.76 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313822 0.76 BCL2 (0.58) 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