SCHEMBL1128550

SCHEMBL1128550

CCOc1ccc(Oc2ncnc3c2cnn3C2CCN(C(=O)OC3CCCC3)CC2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.51
GPR119 Q8TDV5 8/20 0.45
PIK3CD O00329 2/20 0.43
CYP2C9 P11712 3/20 0.42
MAPK8 P45983 1/20 0.40
KCNH2 Q12809 1/20 0.39
SRC P12931 2/20 0.39
FLT3 P36888 1/20 0.38
PDE9A O76083 2/20 0.38
MMP1 P03956 1/20 0.37
MMP13 P45452 1/20 0.37

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
SCHEMBL1128460 0.90 CYP3A4 (0.49) CYP3A4GPR119PIK3CDCYP2C9SRC
SCHEMBL1128256 0.89 CYP3A4 (0.52) CYP3A4GPR119PIK3CDCYP2C9KCNH2
SCHEMBL4328580 0.89 CYP3A4 (0.51) CYP3A4GPR119PIK3CDCYP2C9MAPK8
SCHEMBL1128531 0.88 CYP3A4 (0.66) CYP3A4GPR119PIK3CDCYP2C9
SCHEMBL1128851 0.86 CYP3A4 (0.60) CYP3A4GPR119CYP2C9KCNH2
SCHEMBL9006277 0.81 SRC (0.45) CYP3A4PIK3CDMAPK8SRCFLT3
SCHEMBL1128408 0.80 CYP3A4 (0.53) CYP3A4GPR119
SCHEMBL4355950 0.79 CYP3A4 (0.62) CYP3A4GPR119CYP2C9KCNH2
Trifluoroacetic Acid SCHEMBL1128482 0.79 CYP3A4 (0.45) CYP3A4PIK3CDCYP2C9SRCFLT3
SCHEMBL1128671 0.79 CYP3A4 (0.53) CYP3A4GPR119

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 7 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
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 1503/4885GPR119 1/4885PIK3CD 2624/4885

“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.