SCHEMBL14880381

SCHEMBL14880381

COc1ccc(-c2ccc3ncnc(-c4cncc(C(=O)O)c4)c3c2)cn1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.72
PIK3CA P42336 10/20 0.72
PIK3CB P42338 9/20 0.72
KCNH2 Q12809 4/20 0.72
PIK3CG P48736 8/20 0.58
IRAK4 Q9NWZ3 1/20 0.47
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
MTOR P42345 1/20 0.42

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
SCHEMBL14880326 0.87 PIK3CD (0.72) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14880718 0.87 PIK3CD (0.66) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14883851 0.84 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14883904 0.84 PIK3CD (0.87) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL182805 0.83 PIK3CD (0.58) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL182914 0.81 MKNK1 (0.64) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14880669 0.81 PIK3CD (0.93) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14880446 0.81 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL14880752 0.81 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG
SCHEMBL182718 0.81 PIK3CD (0.61) PIK3CDPIK3CAPIK3CBKCNH2PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9949979-B2 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2018-04-24 US disclosed
US-9949979-B2 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2018-04-24 US disclosed
US-9949979-B2 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2018-04-24 US disclosed
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K NOVARTIS AG (CH) 2015-12-03 US disclosed
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K NOVARTIS AG (CH) 2015-12-03 US disclosed
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K NOVARTIS AG (CH) 2015-12-03 US disclosed
EP-2790705-A1 USE OF INHIBITORS OF THE ACTIVITY OR FUNCTION OF PI3K Novartis AG (CH) 2014-10-22 EP disclosed
US-20140249139-A1 Quinazoline Derivatives NOVARTIS AG (US) 2014-09-04 US disclosed
US-20140249139-A1 Quinazoline Derivatives NOVARTIS AG (US) 2014-09-04 US disclosed
US-20140249139-A1 Quinazoline Derivatives NOVARTIS AG (US) 2014-09-04 US disclosed
EP-2768813-A1 QUINAZOLINE DERIVATIVES AS PI3K MODULATORS Novartis AG (CH) 2014-08-27 EP disclosed
WO-2013088404-A1 Use of inhibitors of the activity or function of PI3K NOVARTIS AG (CH) 2013-06-20 WO disclosed
WO-2013057711-A1 QUINAZOLINE DERIVATIVES AS PI3K MODULATORS NOVARTIS AG (CH) 2013-04-25 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 (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-20140249139-A1 Quinazoline Derivatives XDH, PIK3CA, PIK3R4 PIK3CD 5/4885PIK3CA 2/4885PIK3CB 18/4885
US-20150342951-A1 Use of Inhibitors of the Activity or Function of PI3K TLR9, PIK3CD, PIK3R5 PIK3CD 2/4885PIK3CA 8/4885PIK3CB 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.