SCHEMBL15023341

SCHEMBL15023341

Cc1c(Cn2c(C)nc3c(B(O)O)cc(N4CCOCC4)cc32)cccc1C(F)(F)F

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 13/20 0.81
PIK3CB P42338 8/20 0.77
PIK3CD O00329 6/20 0.77
PIK3R1 P27986 1/20 0.77
PIK3CG P48736 5/20 0.56
PIK3CA P42336 3/20 0.56
MTOR P42345 1/20 0.54

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
SCHEMBL15023804 0.92 PIK3C2B (0.79) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL15023344 0.91 PIK3C2B (0.73) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL15023771 0.91 PIK3C2B (0.68) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL1281638 0.90 PIK3C2B (0.82) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL15022723 0.90 PIK3C2B (0.67) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL15023469 0.90 PIK3C2B (0.71) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL1281747 0.90 PIK3C2B (1.00) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL1281461 0.89 PIK3C2B (1.00) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL21085717 0.88 PIK3C2B (0.77) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG
SCHEMBL1633027 0.87 PIK3C2B (0.87) PIK3C2BPIK3CBPIK3CDPIK3R1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778937-B2 Benzimidazole boronic acid derivatives as PI3 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2014-07-15 US claimed
US-20130157977-A1 Benzimidazole Boronic Acid Derivatives As PI3 Kinase Inhibitors GLAXOSMITHKLINE LLC (US) 2013-06-20 US claimed
US-8778937-B2 Benzimidazole boronic acid derivatives as PI3 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2014-07-15 US disclosed
US-8778937-B2 Benzimidazole boronic acid derivatives as PI3 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2014-07-15 US disclosed
US-8778937-B2 Benzimidazole boronic acid derivatives as PI3 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2014-07-15 US disclosed
US-20130157977-A1 Benzimidazole Boronic Acid Derivatives As PI3 Kinase Inhibitors GLAXOSMITHKLINE LLC (US) 2013-06-20 US disclosed
US-20130157977-A1 Benzimidazole Boronic Acid Derivatives As PI3 Kinase Inhibitors GLAXOSMITHKLINE LLC (US) 2013-06-20 US disclosed
US-20130157977-A1 Benzimidazole Boronic Acid Derivatives As PI3 Kinase Inhibitors GLAXOSMITHKLINE LLC (US) 2013-06-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130157977-A1 Benzimidazole Boronic Acid Derivatives As PI3 Kinase Inhibitors PI4KB, PI4KA, PIK3CB PIK3C2B 7/4885PIK3CB 3/4885PIK3CD 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.