SCHEMBL15313795

SCHEMBL15313795

Cc1ccccc1NC(=O)c1cc(CCc2ccccc2)c(O)c(O)c1O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 2/20 0.57
ALDH1A1 P00352 5/20 0.51
HPGD P15428 4/20 0.51
KDM4E B2RXH2 3/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
POLB P06746 2/20 0.48
KMT2A Q03164 2/20 0.47
PPARG P37231 1/20 0.47
ALOX12 P18054 2/20 0.46
MEN1 O00255 1/20 0.46
ADRB2 P07550 1/20 0.46
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
SLC16A3 O15427 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44

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
SCHEMBL15313778 0.76 BCL2 (0.56) BCL2ALDH1A1KDM4ELMNAHTT
SCHEMBL15313792 0.76 BCL2 (0.58) BCL2ALDH1A1KDM4ELMNAHTT
SCHEMBL15313788 0.76 BCL2 (0.62) BCL2ALDH1A1KDM4ELMNAMAPK1
SCHEMBL15313790 0.75 BCL2 (0.58) BCL2ALDH1A1KDM4ELMNAHTT
SCHEMBL15314355 0.74 BCL2 (0.56) BCL2ALDH1A1KDM4ELMNAHTT
SCHEMBL15313847 0.73 BCL2 (1.00) BCL2ALDH1A1HPGDKDM4ELMNA
SCHEMBL15313786 0.73 BCL2 (0.67) BCL2ALDH1A1KDM4ELMNAHTT
SCHEMBL15313783 0.73 BCL2 (0.59) BCL2ALDH1A1KDM4ELMNAPOLB
SCHEMBL15313791 0.71 LMNA (0.57) ALDH1A1LMNARAB9ANPC1
SCHEMBL3690385 0.70 HPGD (0.77) ALDH1A1HPGDKDM4ELMNAHTT

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