SCHEMBL10187731

SCHEMBL10187731

Cc1ncc(-c2cc(-c3nnc(CN4CCN5CCC[C@H]5C4)o3)c3cn[nH]c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 6/20 0.43
PIK3CA P42336 14/20 0.42
PIK3R1 P27986 8/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 2/20 0.41
PIK3R2 O00459 1/20 0.41
MTOR P42345 1/20 0.40

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
SCHEMBL456900 0.92 PIK3CA (0.51) PIK3CAPIK3R1PIK3CDPIK3CBPIK3CG
SCHEMBL10187727 0.89 PIK3CD (0.49) PIK3CAPIK3R1PIK3CDPIK3CBPIK3CG
SCHEMBL10187720 0.86 PIK3CD (0.48) PIK3C3PIK3CAPIK3R1PIK3CDPIK3CB
SCHEMBL10187622 0.85 PIK3C3 (0.39) PIK3C3PIK3CAPIK3R1PIK3CDPIK3CB
SCHEMBL10187718 0.85 PIK3CA (0.44) PIK3C3PIK3CAPIK3R1PIK3CDPIK3CB
SCHEMBL470449 0.81 PIK3CD (0.61) PIK3C3PIK3CAPIK3R1PIK3CDPIK3CB
SCHEMBL470140 0.79 PIK3CA (0.66) PIK3CAPIK3R1PIK3CDPIK3CBPIK3CG
SCHEMBL456861 0.78 PIK3CA (0.46) PIK3CAPIK3R1PIK3CDPIK3CBPIK3CG
SCHEMBL459638 0.78 PIK3CA (0.59) PIK3CAPIK3R1PIK3CDPIK3CBPIK3CG
SCHEMBL10187726 0.78 PIK3CA (0.43) PIK3C3PIK3CAPIK3R1PIK3CDPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9326987-B2 Indazole derivatives for use in the treatment of influenza virus infection GLAXO GROUP LIMITED (GB) 2016-05-03 US disclosed
US-8524751-B2 4-oxadiazol-2-YL-indazoles as inhibitors of P13 kinases GlaxoSmithKline Intellecutual Property Development (GB) 2013-09-03 US disclosed
US-20130165433-A1 Novel Use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-06-27 US disclosed
US-20120053166-A1 4-Oxadiazol-2-YL-Indazoles as Inhibitors of P13 Kinases GLAXO GROUP LIMITED (GB) 2012-03-01 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 (2 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-20130165433-A1 Novel Use HAVCR2, MAVS, ENTPD5 PIK3C3 4369/4885PIK3CA 2691/4885PIK3R1 3030/4885
US-20120053166-A1 4-Oxadiazol-2-YL-Indazoles as Inhibitors of P13 Kinases CDK3, CDK13, AKT3 PIK3C3 7/4885PIK3CA 6/4885PIK3R1 153/4885

“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.