SCHEMBL16490378

SCHEMBL16490378

Cc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)NCc1ccccn1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.62
PIK3CG P48736 6/20 0.62
PI4KB Q9UBF8 10/20 0.54
PIK3CA P42336 2/20 0.52
PIK3C2G O75747 1/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PIK3C3 Q8NEB9 2/20 0.46
PIK3C2A O00443 1/20 0.46
PIK3C2B O00750 1/20 0.46
PIK3CB P42338 1/20 0.46
PI4KA P42356 1/20 0.46
PRKDC P78527 1/20 0.46

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
SCHEMBL14851929 0.91 PI4KB (0.68) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490368 0.86 PI4KB (0.63) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490367 0.86 PIK3CD (0.65) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490427 0.85 PIK3CD (0.62) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490380 0.85 PIK3CD (0.62) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490439 0.84 PIK3CD (0.72) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490460 0.83 PI4KB (0.66) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL17904349 0.81 PI4KB (0.62) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL17904350 0.81 PI4KB (0.71) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G
SCHEMBL16490362 0.81 PI4KB (0.71) PIK3CDPIK3CGPI4KBPIK3CAPIK3C2G

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-9309236-B2 PI-kinase inhibitors with broad spectrum anti-infective activity THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2016-04-12 US disclosed
US-20150051193-A1 PI-kinase Inhibitors with Broad Spectrum Anti-Infective Activity THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2015-02-19 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-20150051193-A1 PI-kinase Inhibitors with Broad Spectrum Anti-Infective Activity PIP4K2A, PIP5K1A, PIP4K2C PIK3CD 20/4885PIK3CG 22/4885PI4KB 9/4885

“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.