SCHEMBL3539253

SCHEMBL3539253

Nc1nc(N)c2nc(-c3cccc(O)c3)c(-c3c(Br)ccc(O)c3Br)nc2n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 13/20 0.72
PIK3CA P42336 2/20 0.72
PIK3CB P42338 2/20 0.72
MTOR P42345 2/20 0.72
PIK3CD O00329 1/20 0.72
PIK3C2B O00750 1/20 0.72
PDXK O00764 1/20 0.72
GAK O14976 1/20 0.72
MAP3K7 O43318 1/20 0.72
RIPK2 O43353 1/20 0.72
PIP5K1C O60331 1/20 0.72
STK16 O75716 1/20 0.72
PIK3C2G O75747 1/20 0.72
PRKD3 O94806 1/20 0.72
OXSR1 O95747 1/20 0.72
LATS1 O95835 1/20 0.72
ABL1 P00519 1/20 0.72
EGFR P00533 1/20 0.72
ERBB2 P04626 1/20 0.72
LCK P06239 1/20 0.72

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
Tg100-115 SCHEMBL29361550 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL31238338 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL29411790 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL360279 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL29506727 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL29369340 0.85 PIK3CG (1.00) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL3537211 0.83 PIK3CG (0.97) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL3539251 0.83 PIK3CG (0.97) PIK3CGPIK3CAPIK3CBMTORPIK3CD
Tg100-115 SCHEMBL3539255 0.83 PIK3CG (0.97) PIK3CGPIK3CAPIK3CBMTORPIK3CD
SCHEMBL1648630 0.78 PIK3CG (0.81) PIK3CGPIK3CAPIK3CBMTORPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2039683-B1 Vasculostatic agents and methods of use thereof TARGEGEN INC (US) 2012-12-19 EP disclosed
US-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof TARGEGEN, INC. (US) 2010-12-30 US disclosed
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN INC. 2010-11-04 US disclosed
US-7691858-B2 Kinase inhibitors and methods of use thereof TARGEGEN, INC. (US) 2010-04-06 US disclosed
EP-2039683-A2 Vasculostatic agents and methods of use thereof Targegen, Inc. (US) 2009-03-25 EP disclosed
EP-1549614-A4 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN INC (US) 2008-04-16 EP disclosed
WO-2007127366-A2 KINASE INHIBITORS AND METHODS OF USE THEREOF TARGEGEN, INC. (US) 2007-11-08 WO disclosed
US-20070259876-A1 Kinase inhibitors and methods of use thereof TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070208019-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. 2007-09-06 US disclosed
US-7208493-B2 Vasculostatic agents and methods of use thereof TARGEGEN, INC. (US) 2007-04-24 US disclosed
US-20050282814-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. (US) 2005-12-22 US disclosed
EP-1549614-A2 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF Targegen, Inc. (US) 2005-07-06 EP disclosed
US-20040167198-A1 Vasculostatic agents and methods of use thereof TARGEGEN, INC. 2004-08-26 US disclosed
WO-2004030635-A2 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF TARGEGEN, INC. (US) 2004-04-15 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 (6 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-20070259876-A1 Kinase inhibitors and methods of use thereof ROCK1, ADCK1, MAP3K20 PIK3CG 180/4885PIK3CA 163/4885PIK3CB 185/4885
US-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885PIK3CA 3097/4885PIK3CB 2679/4885
US-20050282814-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885PIK3CA 3097/4885PIK3CB 2679/4885
US-20070208019-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885PIK3CA 3097/4885PIK3CB 2679/4885
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF RBP1, RBP4, VCAM1 PIK3CG 2378/4885PIK3CA 3097/4885PIK3CB 2679/4885
US-20040167198-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885PIK3CA 3097/4885PIK3CB 2679/4885

“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.