SCHEMBL15313812

SCHEMBL15313812

O=C(Nc1cc(S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl)c1ccc(O)c(O)c1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 3/20 0.68
BCL2 P10415 1/20 0.68
ALDH1A1 P00352 5/20 0.51
SLC16A1 P53985 1/20 0.48
POLB P06746 3/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
CYP2C9 P11712 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
MAPT P10636 1/20 0.44
PIK3CA P42336 1/20 0.44
KCNMA1 Q12791 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43

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
SCHEMBL15313811 0.85 BCL2 (0.71) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL15313832 0.83 BCL2L1 (0.63) BCL2L1BCL2ALDH1A1POLBLMNA
SCHEMBL4304061 0.82 BCL2L1 (0.77) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL29377616 0.82 BCL2L1 (0.77) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL15313800 0.82 BCL2L1 (0.60) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL14163444 0.81 BCL2L1 (1.00) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL14264656 0.81 BCL2 (1.00) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL5150417 0.81 BCL2L1 (0.69) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL13242107 0.80 BCL2 (0.85) BCL2L1BCL2ALDH1A1SLC16A1POLB
SCHEMBL15313785 0.80 BCL2 (0.67) BCL2L1BCL2ALDH1A1SLC16A1POLB

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