SCHEMBL16490446

SCHEMBL16490446

CCN(CC)C(=O)Nc1nc(C)c(-c2ccc(C)c(S(=O)(=O)Nc3ccc(O)cc3)c2)s1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 5/20 0.63
PIK3CD O00329 4/20 0.63
PIK3C3 Q8NEB9 2/20 0.63
PIK3C2G O75747 6/20 0.59
PIK3CA P42336 3/20 0.59
PI4KB Q9UBF8 12/20 0.58
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 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
SCHEMBL16490454 0.93 PIK3CG (0.61) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL31323380 0.90 PIK3C2G (0.75) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL14851656 0.90 PIK3C2G (0.75) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490596 0.88 PIK3CG (0.66) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490450 0.85 PIK3CG (0.67) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490346 0.85 PIK3CD (0.80) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490449 0.85 PI4KB (0.65) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490386 0.84 PIK3CG (0.66) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490447 0.83 PIK3CG (0.65) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA
SCHEMBL16490358 0.83 PIK3CG (0.69) PIK3CGPIK3CDPIK3C3PIK3C2GPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180170924-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2018-06-21 US disclosed
US-9926309-B2 Pi-kinase inhibitors with anti-infective activity THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-03-27 US disclosed
US-20160194314-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-07-07 US disclosed
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 (3 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 PIK3CG 22/4885PIK3CD 20/4885PIK3C3 29/4885
US-20180170924-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY PIP4K2A, PIP5K1A, PIP4K2C PIK3CG 21/4885PIK3CD 20/4885PIK3C3 27/4885
US-20160194314-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY PIP4K2A, PIP5K1A, PIP4K2C PIK3CG 21/4885PIK3CD 20/4885PIK3C3 27/4885

“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.