SCHEMBL16490441

SCHEMBL16490441

Cc1ccc(-c2sc(NC(=O)CC3CCCCC3)nc2C)cc1S(=O)(=O)NC(C)C

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 16/20 0.71
PIK3C2G O75747 4/20 0.58
PIK3CD O00329 1/20 0.49
PIK3CG P48736 1/20 0.49

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
SCHEMBL17904345 0.92 PI4KB (0.68) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL16490442 0.91 PI4KB (0.70) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL20265326 0.90 PI4KB (0.74) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL14851749 0.90 PI4KB (0.74) PI4KBPIK3C2G
SCHEMBL31323374 0.90 PI4KB (0.74) PI4KBPIK3C2G
SCHEMBL20265850 0.88 PI4KB (0.72) PI4KBPIK3C2GPIK3CG
SCHEMBL17889634 0.87 PI4KB (0.70) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL16490384 0.86 PI4KB (0.82) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL16490437 0.86 PIK3CD (0.62) PI4KBPIK3C2GPIK3CDPIK3CG
SCHEMBL16490566 0.86 PI4KB (0.82) PI4KBPIK3C2GPIK3CDPIK3CG

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 PI4KB 9/4885PIK3C2G 89/4885PIK3CD 20/4885
US-20180170924-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY PIP4K2A, PIP5K1A, PIP4K2C PI4KB 9/4885PIK3C2G 100/4885PIK3CD 20/4885
US-20160194314-A1 PI-KINASE INHIBITORS WITH ANTI-INFECTIVE ACTIVITY PIP4K2A, PIP5K1A, PIP4K2C PI4KB 9/4885PIK3C2G 100/4885PIK3CD 20/4885

“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.