SCHEMBL1128465

SCHEMBL1128465

CC(=O)Nc1ccc(Oc2ncnc3c2cnn3C2CCN(C(=O)OC(C)C)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.59
PIK3CA P42336 4/20 0.49
MTOR P42345 4/20 0.49
PIK3CG P48736 3/20 0.48
ATR Q13535 1/20 0.48
NR3C1 P04150 3/20 0.48
GPR119 Q8TDV5 7/20 0.47
FLT3 P36888 4/20 0.45
CYP2C9 P11712 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
SCHEMBL2019853 0.89 CYP3A4 (0.61) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL1128724 0.88 CYP3A4 (0.61) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL4358437 0.88 CYP3A4 (0.59) CYP3A4NR3C1FLT3CYP2C9
SCHEMBL1128307 0.88 CYP3A4 (0.76) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL1128407 0.86 CYP3A4 (0.79) CYP3A4GPR119CYP2C9KCNH2
SCHEMBL2016396 0.85 CYP3A4 (0.57) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL1128367 0.84 CYP3A4 (0.57) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL2017035 0.83 CYP3A4 (0.55) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL4357368 0.82 CYP3A4 (0.54) CYP3A4PIK3CAMTORPIK3CGATR
SCHEMBL2021684 0.82 CYP3A4 (0.54) CYP3A4PIK3CAMTORPIK3CGATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188098-B2 GPR119 receptor agonists HOFFMANN-LA ROCHE INC. (US) 2012-05-29 US claimed
EP-2283019-A1 GPR119 RECEPTOR AGONISTS F. Hoffmann-La Roche AG (CH) 2011-02-16 EP claimed
WO-2009141238-A1 GPR119 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-11-26 WO claimed
US-20090286812-A1 GPR119 Receptor Agonists ERICKSON SHAWN DAVID 2009-11-19 US claimed
US-8188098-B2 GPR119 receptor agonists HOFFMANN-LA ROCHE INC. (US) 2012-05-29 US disclosed
US-8188098-B2 GPR119 receptor agonists HOFFMANN-LA ROCHE INC. (US) 2012-05-29 US disclosed
EP-2283019-A1 GPR119 RECEPTOR AGONISTS F. Hoffmann-La Roche AG (CH) 2011-02-16 EP disclosed
WO-2009141238-A1 GPR119 RECEPTOR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-11-26 WO disclosed
US-20090286812-A1 GPR119 Receptor Agonists ERICKSON SHAWN DAVID 2009-11-19 US disclosed
US-20090286812-A1 GPR119 Receptor Agonists ERICKSON SHAWN DAVID 2009-11-19 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 (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-20090286812-A1 GPR119 Receptor Agonists GPR119, GPR27, GPR139 CYP3A4 1503/4885PIK3CA 2697/4885MTOR 3887/4885

“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.