SCHEMBL15313867

SCHEMBL15313867

CC(C)(C)c1ccccc1Oc1ccc(NC(=O)c2cc(-c3ccc4ccccc4c3)c(O)c(O)c2O)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 6/20 0.49
IDO1 P14902 2/20 0.46
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
STK39 Q9UEW8 2/20 0.43
MITF O75030 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
BCL2L1 Q07817 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
P2RY1 P47900 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 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
SCHEMBL15313854 0.82 BCL2L1 (0.64) PARGMEN1KMT2APOLBBCL2L1
SCHEMBL15313869 0.71 BCL2L1 (0.61) MEN1KMT2ALMNAPOLBBCL2L1
SCHEMBL15313872 0.71 BCL2 (0.50) MEN1KMT2APOLBBCL2L1NPC1
SCHEMBL15313898 0.71 MAOA (0.46) PARGMEN1KMT2ALMNANPC1
SCHEMBL15313865 0.71 BCL2L1 (0.67) MEN1KMT2ALMNAPOLBBCL2L1
SCHEMBL15313873 0.69 BCL2L1 (0.58) PARGMEN1KMT2APOLBBCL2L1
SCHEMBL15313719 0.68 BCL2 (0.61) MEN1KMT2APOLB
SCHEMBL15313871 0.68 BCL2L1 (0.51) MEN1KMT2ABCL2L1
SCHEMBL15313864 0.67 BCL2L1 (0.65) MEN1KMT2ALMNAPOLBBCL2L1
SCHEMBL17500085 0.67 HDAC4 (0.57)

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