SCHEMBL15313850

SCHEMBL15313850

CCc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1NC(=O)c1cc(Cc2ccccc2C(C)C)c(O)c(O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

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
LMNA P02545 5/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
HTT P42858 2/20 0.39
POLB P06746 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
IDH2 P48735 1/20 0.37
HTR6 P50406 1/20 0.36
MAPT P10636 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL15313851 0.89 BCL2 (0.56) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313842 0.88 BCL2 (0.68) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313852 0.85 BCL2 (0.59) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313911 0.84 BCL2 (0.53) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313845 0.80 BCL2 (0.58) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313846 0.80 BCL2 (0.57) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313838 0.80 BCL2 (0.66) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313844 0.80 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313828 0.78 BCL2 (0.55) BCL2BCL2L1MCL1SIRT5LMNA
SCHEMBL15313801 0.77 BCL2L1 (0.60) 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