SCHEMBL6354575

SCHEMBL6354575

COc1ccc(Nc2ncccc2N)cn1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.61
PIK3CD O00329 11/20 0.61
PIK3CG P48736 11/20 0.61
PIK3CB P42338 10/20 0.61
MTOR P42345 4/20 0.61
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
KMT2A Q03164 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL35262 0.80 RAB9A (0.61) MEN1KMT2ACA12CA1CA2
SCHEMBL29384795 0.80 RAB9A (0.61) MEN1KMT2ACA12CA1CA2
SCHEMBL10094233 0.80 PIK3CA (0.53) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL1373989 0.79 PIK3CA (0.52) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL1375752 0.79 PIK3CA (0.52) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL4938262 0.79 PIK3CA (0.60) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL1372451 0.78 MEN1 (0.56) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL2284031 0.78 KMT2A (0.50) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL23927057 0.77 PIK3CA (0.57) PIK3CAPIK3CDPIK3CGPIK3CBMTOR
SCHEMBL30079596 0.77 PIK3CA (0.57) PIK3CAPIK3CDPIK3CGPIK3CBMTOR

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-6841549-B1 Condensed imidazole compounds and a therapeutic agent for diabetes mellitus EISAI CO., LTD. (JP) 2005-01-11 US disclosed
EP-1221444-A1 FUSED IMIDAZOLE COMPOUNDS AND REMEDIES FOR DIABETES MELLITUS Eisai Co., Ltd. (JP) 2002-07-10 EP disclosed