SCHEMBL15313785

SCHEMBL15313785

O=C(Nc1cc(S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl)c1cc(Cc2ccccc2)c(O)c(O)c1O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 4/20 0.67
BCL2L1 Q07817 5/20 0.60
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
SLC16A1 P53985 1/20 0.48
TP53 P04637 1/20 0.47
ALDH1A1 P00352 5/20 0.45
CYP2C9 P11712 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 3/20 0.43
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MCL1 Q07820 1/20 0.41
SIRT5 Q9NXA8 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
SCHEMBL15313783 0.91 BCL2 (0.59) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313793 0.89 BCL2 (0.59) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313805 0.88 BCL2 (0.58) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313811 0.87 BCL2 (0.71) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313848 0.86 BCL2L1 (0.56) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313809 0.85 BCL2L1 (0.57) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313801 0.85 BCL2L1 (0.60) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313818 0.82 BCL2 (0.54) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313800 0.82 BCL2L1 (0.60) BCL2BCL2L1LMNAPOLBSLC16A1
SCHEMBL15313820 0.81 BCL2 (1.00) BCL2BCL2L1LMNAALDH1A1CYP2C9

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