SCHEMBL15313809

SCHEMBL15313809

O=C(Nc1cc(S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl)c1cc(CCc2cccc(Cl)c2)c(O)c(O)c1O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 3/20 0.57
BCL2 P10415 3/20 0.57
TP53 P04637 1/20 0.45
ALDH1A1 P00352 3/20 0.44
SLC16A1 P53985 1/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.39
HTT P42858 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP2C9 P11712 1/20 0.39
SLC16A3 O15427 1/20 0.38
MAPT P10636 2/20 0.38
MITF O75030 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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 0.92 BCL2 (0.59) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313785 0.85 BCL2 (0.67) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313811 0.85 BCL2 (0.71) BCL2L1BCL2ALDH1A1SLC16A1LMNA
SCHEMBL15313789 0.84 BCL2 (0.57) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313817 0.81 BCL2 (0.60) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313800 0.80 BCL2L1 (0.60) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313848 0.80 BCL2L1 (0.56) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313793 0.79 BCL2 (0.59) BCL2L1BCL2TP53ALDH1A1SLC16A1
SCHEMBL15313805 0.78 BCL2 (0.58) BCL2L1BCL2ALDH1A1SLC16A1LMNA
SCHEMBL15313825 0.78 BCL2L1 (0.51) BCL2L1BCL2ALDH1A1SLC16A1LMNA

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