SCHEMBL1695130

SCHEMBL1695130

CN/C=N/C(=O)c1cc(N2CCOCC2)cc2c1nc(C)n2Cc1cccc2ccccc12

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 20/20 0.74
PIK3CD O00329 1/20 0.55
PIK3R1 P27986 1/20 0.55
PIK3CB P42338 1/20 0.55

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
SCHEMBL1281210 0.89 PIK3C2B (0.74) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281207 0.89 PIK3C2B (0.74) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281229 0.85 PIK3C2B (1.00) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281282 0.85 PIK3C2B (1.00) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1282604 0.85 PIK3C2B (0.82) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281974 0.85 PIK3C2B (0.84) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL27921636 0.84 PIK3C2B (0.83) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281189 0.83 PIK3C2B (0.78) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL10193544 0.83 PIK3C2B (0.78) PIK3C2BPIK3CDPIK3R1PIK3CB
SCHEMBL1281938 0.81 PIK3C2B (0.78) PIK3C2BPIK3CDPIK3R1PIK3CB

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
WO-2012047538-A1 BENZIMIDAZOLE DERIVATIVES AS PI3 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-04-12 WO disclosed