SCHEMBL3745266

SCHEMBL3745266

CS(=O)(=O)ONc1ncnc2nc(-c3cccc(O)c3)c(-c3cccc(O)c3)nc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 11/20 0.55
BRAF P15056 3/20 0.42
PIK3CB P42338 3/20 0.42
PIK3CD O00329 2/20 0.42
CSNK2A2 P19784 2/20 0.42
ABL1 P00519 2/20 0.42
EGFR P00533 2/20 0.42
PIK3CA P42336 2/20 0.42
PIK3C2B O00750 1/20 0.42
PDXK O00764 1/20 0.42
GAK O14976 1/20 0.42
MAP3K7 O43318 1/20 0.42
RIPK2 O43353 1/20 0.42
PIP5K1C O60331 1/20 0.42
STK16 O75716 1/20 0.42
PIK3C2G O75747 1/20 0.42
PRKD3 O94806 1/20 0.42
OXSR1 O95747 1/20 0.42
LATS1 O95835 1/20 0.42
ERBB2 P04626 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
SCHEMBL3732212 0.85 PIK3CG (0.54) PIK3CGBRAFRAF1JAK3
SCHEMBL3745260 0.79 PIK3CG (0.83) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
SCHEMBL3737062 0.72 PIK3CG (1.00) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
Bromide SCHEMBL4361882 0.71 PIK3CG (0.97) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
Hydrochloric Acid SCHEMBL3537202 0.71 PIK3CG (0.97) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
Tg100-115 SCHEMBL3743017 0.68 PIK3CG (0.82) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
SCHEMBL3743019 0.65 PIK3CG (0.70) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
SCHEMBL14313757 0.65 PIK3CG (0.64) PIK3CGPIK3CBPIK3CDJAK3MAP4K4
SCHEMBL10545516 0.64 PIK3CG (0.49) PIK3CGBRAFPIK3CBPIK3CDCSNK2A2
SCHEMBL17089216 0.64 PIK3CG (0.55) PIK3CGPIK3CBPIK3CDABL1EGFR

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 11 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
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
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 (5 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-20100330030-A1 Vasculostatic Agents and Methods of Use Thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885BRAF 718/4885PIK3CB 2679/4885
US-20050282814-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885BRAF 718/4885PIK3CB 2679/4885
US-20070208019-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885BRAF 718/4885PIK3CB 2679/4885
US-20100278811-A1 VASCULOSTATIC AGENTS AND METHODS OF USE THEREOF RBP1, RBP4, VCAM1 PIK3CG 2378/4885BRAF 718/4885PIK3CB 2679/4885
US-20040167198-A1 Vasculostatic agents and methods of use thereof RBP1, RBP4, VCAM1 PIK3CG 2378/4885BRAF 718/4885PIK3CB 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.