SCHEMBL1128370

SCHEMBL1128370

CC(C)(C)OC(=O)N1CCC(n2ncc3c(Oc4ccccc4C#N)ncnc32)CC1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.65
CYP2C9 P11712 1/20 0.50
NR3C1 P04150 2/20 0.49
GPR119 Q8TDV5 9/20 0.46
PIK3CA P42336 3/20 0.43
MTOR P42345 3/20 0.43
PIK3CG P48736 2/20 0.43
ATR Q13535 2/20 0.43
AURKB Q96GD4 1/20 0.43
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
PIK3CD O00329 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.41
SLC2A1 P11166 1/20 0.41
SLC2A2 P11168 1/20 0.41
SLC2A3 P11169 1/20 0.41

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
SCHEMBL1128458 0.90 CYP3A4 (0.53) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL4358056 0.89 CYP3A4 (0.49) CYP3A4CYP2C9GPR119SLC2A1SLC2A2
SCHEMBL1128987 0.89 CYP3A4 (0.61) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128319 0.89 CYP3A4 (0.61) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128887 0.88 CYP3A4 (0.63) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128304 0.88 CYP3A4 (0.50) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128481 0.88 CYP3A4 (0.50) CYP3A4CYP2C9NR3C1GPR119SLC2A1
SCHEMBL1128487 0.87 CYP3A4 (0.68) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128369 0.87 PIK3CA (0.49) CYP3A4CYP2C9NR3C1GPR119PIK3CA
SCHEMBL1128532 0.87 CYP3A4 (0.61) CYP3A4CYP2C9NR3C1GPR119PIK3CA

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 12 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
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
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 1503/4885CYP2C9 917/4885NR3C1 316/4885

“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.