SCHEMBL15313800

SCHEMBL15313800

O=C(Nc1cc(S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl)c1cc(CCc2ccccc2)cc(O)c1O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 3/20 0.60
BCL2 P10415 2/20 0.60
TP53 P04637 1/20 0.54
SLC16A1 P53985 1/20 0.48
ALDH1A1 P00352 6/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 4/20 0.45
KDM4E B2RXH2 1/20 0.44
XBP1 P17861 1/20 0.44
CYP2C9 P11712 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 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 0.87 BCL2 (0.59) BCL2L1BCL2TP53SLC16A1ALDH1A1
SCHEMBL15313785 0.82 BCL2 (0.67) BCL2L1BCL2TP53SLC16A1ALDH1A1
SCHEMBL15313812 0.82 BCL2L1 (0.68) BCL2L1BCL2SLC16A1ALDH1A1LMNA
SCHEMBL15313809 0.80 BCL2L1 (0.57) BCL2L1BCL2TP53SLC16A1ALDH1A1
SCHEMBL15313796 0.79 BCL2 (0.54) BCL2ALDH1A1LMNAMAPTMEN1
SCHEMBL15313811 0.77 BCL2 (0.71) BCL2L1BCL2SLC16A1ALDH1A1LMNA
SCHEMBL13242107 0.77 BCL2 (0.85) BCL2L1BCL2SLC16A1ALDH1A1LMNA
SCHEMBL4304061 0.76 BCL2L1 (0.77) BCL2L1BCL2SLC16A1ALDH1A1LMNA
SCHEMBL29377616 0.76 BCL2L1 (0.77) BCL2L1BCL2SLC16A1ALDH1A1LMNA
SCHEMBL15313789 0.76 BCL2 (0.57) BCL2L1BCL2TP53SLC16A1ALDH1A1

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