SCHEMBL1251685

SCHEMBL1251685

NC(=O)c1ncccc1-c1cc(-c2cccc3[nH]ccc23)cc2c1cnn2S(=O)(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.39
PIK3CB P42338 4/20 0.39
GSK3B P49841 3/20 0.39
PIK3CG P48736 2/20 0.39
PIM1 P11309 2/20 0.39
PIK3CA P42336 1/20 0.39
FTO Q9C0B1 1/20 0.37
HTR6 P50406 3/20 0.36
HPGDS O60760 3/20 0.35
ASH1L Q9NR48 1/20 0.35
PIP4K2A P48426 1/20 0.34
PIP4K2B P78356 1/20 0.34
PIP4K2C Q8TBX8 1/20 0.34
FLT3 P36888 2/20 0.33
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
PRKCI P41743 1/20 0.33
ABL1 P00519 1/20 0.33
PRKCA P17252 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL1431709 0.83 HTR2B (0.37) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL459027 0.82 HTR6 (0.41) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL1251686 0.80 PIK3CD (0.62) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL470164 0.78 HTR6 (0.37) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL463569 0.78 HTR6 (0.39) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL459116 0.76 PIK3CD (0.59) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL716071 0.75 ATR (0.35) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL717170 0.74 PIP4K2A (0.35) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL1431711 0.74 PIK3CD (0.51) PIK3CDPIK3CBGSK3BPIK3CGPIM1
SCHEMBL1779260 0.73 PIK3CD (0.49) PIK3CDPIK3CBGSK3BPIK3CGPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280959-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2011-02-09 EP disclosed