SCHEMBL1128974

SCHEMBL1128974

CS(=O)(=O)c1ccc(Oc2ncnc3c2cnn3C2CCN(Cc3nccs3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.69
SCN9A Q15858 1/20 0.42
GPR119 Q8TDV5 10/20 0.41
CYP2C9 P11712 1/20 0.39
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPK1 P28482 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
SCHEMBL1128946 0.85 CYP3A4 (0.80) CYP3A4SCN9A
SCHEMBL1128689 0.84 CYP3A4 (0.82) CYP3A4MAPK1
SCHEMBL1128783 0.84 CYP3A4 (0.82) CYP3A4GPR119CYP2C9MAPK1
SCHEMBL1129071 0.83 CYP3A4 (0.83) CYP3A4GPR119CYP2C9PTGS1PTGS2
SCHEMBL4362241 0.82 CYP3A4 (0.78) CYP3A4GPR119CYP2C9
SCHEMBL1128932 0.82 CYP3A4 (0.69) CYP3A4GPR119CYP2C9
SCHEMBL1128847 0.81 CYP3A4 (0.68) CYP3A4GPR119CYP2C9
SCHEMBL4356675 0.81 CYP3A4 (0.68) CYP3A4GPR119CYP2C9CYP2D6
SCHEMBL4364480 0.81 CYP3A4 (1.00) CYP3A4SCN9AGPR119CYP2C9
SCHEMBL1128729 0.81 CYP3A4 (0.74) CYP3A4SCN9ACYP2C9MAPK1

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 9 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
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 1503/4885SCN9A 1052/4885GPR119 1/4885

“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.