SCHEMBL1701994

SCHEMBL1701994

COc1ncc(Br)cc1S(=O)(=O)NC1COCCO1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.37
PIK3CG P48736 7/20 0.37
PIK3CA P42336 6/20 0.37
PIK3CB P42338 5/20 0.37
PIK3R1 P27986 4/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
PIK3C2G O75747 2/20 0.35
PIK3C3 Q8NEB9 2/20 0.35
SHMT2 P34897 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
OPRK1 P41145 1/20 0.34
ALPL P05186 2/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL9953196 0.80 PIK3CG (0.46) PIK3CDPIK3CGPIK3CAPIK3CBPIK3R1
SCHEMBL9954020 0.78 PIK3C3 (0.49) PIK3CGMEN1POLBKMT2APIK3C2G
SCHEMBL14305926 0.76 PIK3C3 (0.55) MEN1POLBKMT2APIK3C3KDM4E
SCHEMBL9954686 0.76 PIK3C3 (0.53) MEN1POLBKMT2APIK3C3KDM4E
SCHEMBL19303684 0.75 PIK3C2G (0.48) PIK3CDPIK3CGPIK3CAPIK3CBMEN1
SCHEMBL21760960 0.75 PIK3C2G (0.48) PIK3CDPIK3CGPIK3CAPIK3CBMEN1
SCHEMBL9953075 0.75 PIK3C3 (0.52) MEN1POLBKMT2APIK3C3KDM4E
SCHEMBL9953641 0.73 SHMT2 (0.44) PIK3CDMEN1POLBKMT2ASHMT2
SCHEMBL9953667 0.72 PIK3C3 (0.42) PIK3CDPIK3CGPIK3CAPIK3CBPIK3R1
SCHEMBL9954692 0.71 SHMT2 (0.42) MEN1POLBKMT2APIK3C3SHMT2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632436-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT Abbvie Inc. (US) 2013-09-04 EP disclosed
EP-2613769-A1 MELT-EXTRUDED SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT Abbvie Inc. (US) 2013-07-17 EP disclosed
EP-2576546-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbvie Inc. (US) 2013-04-10 EP disclosed
WO-2012121758-A1 MELT-EXTRUDED SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT ABBVIE INC. (US) 2012-09-13 WO disclosed
WO-2012058392-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT ABBOTT LABORATORIES (US) 2012-05-03 WO disclosed
EP-2435432-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbott Laboratories (US) 2012-04-04 EP disclosed
WO-2011149492-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-12-01 WO disclosed
WO-2010138588-A9 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-05-05 WO disclosed
WO-2010138588-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2010-12-02 WO disclosed