SCHEMBL14851745

SCHEMBL14851745

COc1ccc(-c2sc(NC(=O)C3CCCC3)nc2C)cc1S(=O)(=O)NCCCN1CCOCC1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.62
PIK3C2G O75747 4/20 0.62
PIK3CG P48736 3/20 0.62
PIK3CA P42336 1/20 0.62
PI4KB Q9UBF8 13/20 0.61

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
SCHEMBL16490408 0.91 PIK3CD (0.61) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL50025 0.90 PIK3CD (0.71) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL14851728 0.90 PIK3CD (0.67) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL14851718 0.86 PIK3CD (0.73) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL14851705 0.85 PIK3CD (0.72) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL14851907 0.84 PI4KB (0.66) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL48376 0.83 PIK3CD (0.73) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL16490401 0.80 PIK3CD (0.67) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL48581 0.80 PIK3CD (0.76) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB
SCHEMBL14851953 0.80 PIK3C2G (0.75) PIK3CDPIK3C2GPIK3CGPIK3CAPI4KB

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 3 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
WO-2013052845-A1 PI-KINASE INHIBITORS WITH BROAD SPECTRUM ANTI-INFECTIVE ACTIVITY THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2013-04-11 WO 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 20/4885PIK3C2G 89/4885PIK3CG 22/4885

“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.