SCHEMBL15313693

SCHEMBL15313693

O=C(c1ccc(Oc2ccccc2)cc1)c1cc(Cc2ccccc2)c(O)c(O)c1O

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 6/20 0.68
MCL1 Q07820 4/20 0.68
BAD Q92934 2/20 0.58
SRD5A2 P31213 6/20 0.52
PTPN1 P18031 2/20 0.47
PTPN2 P17706 1/20 0.47
PTPN6 P29350 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL9325719 0.93 BCL2 (0.62) BCL2MCL1BADSRD5A2PTPN1
SCHEMBL15313722 0.85 BCL2 (0.78) BCL2MCL1BADSRD5A2POLB
SCHEMBL15313694 0.82 LTA4H (0.52) BCL2MCL1SRD5A2PTPN1PTPN2
SCHEMBL15313723 0.80 MCL1 (0.71) BCL2MCL1BADSRD5A2POLB
SCHEMBL8430837 0.80 BCL2 (0.59) BCL2MCL1PTPN1PTPN2PTPN6
SCHEMBL5698161 0.79 BCL2 (0.58) BCL2MCL1PTPN1PTPN2PTPN6
SCHEMBL15313721 0.78 BCL2 (0.72) BCL2MCL1BADSRD5A2POLB
SCHEMBL13764672 0.78 SRD5A2 (0.77) SRD5A2POLB
SCHEMBL28707306 0.78 PTPN1 (0.73) BCL2PTPN1PTPN2PTPN6
SCHEMBL9636703 0.77 BCL2 (0.49) BCL2MCL1SRD5A2PTPN1PTPN2

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