SCHEMBL2371910

SCHEMBL2371910

CC(C)c1nc(N2CCC([C@H](C)CCOc3ccc(S(C)(=O)=O)c(F)c3)CC2)no1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.44
KCNH2 Q12809 1/20 0.36
ACACB O00763 2/20 0.36
ACACA Q13085 2/20 0.36

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
SCHEMBL1712882 0.88 GPR119 (0.41) GPR119KCNH2ACACBACACA
SCHEMBL2371660 0.87 GPR119 (0.56) GPR119KCNH2
SCHEMBL2370710 0.86 GPR119 (0.45) GPR119KCNH2
SCHEMBL2568023 0.85 ACACB (0.39) GPR119KCNH2ACACBACACA
SCHEMBL2568018 0.85 ACACB (0.39) GPR119KCNH2ACACBACACA
SCHEMBL2370813 0.85 GPR119 (0.51) GPR119KCNH2
SCHEMBL174827 0.85 GPR119 (0.51) GPR119KCNH2
SCHEMBL1712886 0.84 GPR119 (0.37) GPR119KCNH2
SCHEMBL2372010 0.82 GPR119 (0.43) GPR119KCNH2
SCHEMBL2372093 0.80 GPR119 (0.49) GPR119KCNH2ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130109703-A1 Combination of a GPR119 Agonist and the DPP-IV Inhibitor Linagliptin for Use in the Treatment of Diabetes and Related Conditions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US claimed
EP-2547339-A1 COMBINATION OF A GPR119 AGONIST AND THE DPP-IV INHIBITOR LINAGLIPTIN FOR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS Boehringer Ingelheim International GmbH (DE) 2013-01-23 EP claimed
WO-2011113947-A1 COMBINATION OF A GPR119 AGONIST AND THE DPP-IV INHIBITOR LINAGLIPTIN FOR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-22 WO claimed
EP-2114933-B1 PIPERIDINE GPCR AGONISTS PROSIDION LTD (GB) 2011-09-07 EP claimed
US-20100048632-A1 Piperidine GPCR Agonists PROSIDION LIMITED (GB) 2010-02-25 US claimed
US-20130109703-A1 Combination of a GPR119 Agonist and the DPP-IV Inhibitor Linagliptin for Use in the Treatment of Diabetes and Related Conditions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US disclosed
EP-2547339-A1 COMBINATION OF A GPR119 AGONIST AND THE DPP-IV INHIBITOR LINAGLIPTIN FOR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS Boehringer Ingelheim International GmbH (DE) 2013-01-23 EP disclosed
EP-2377863-A1 Piperidine GPCR agonists Prosidion Limited (GB) 2011-10-19 EP disclosed
WO-2011113947-A1 COMBINATION OF A GPR119 AGONIST AND THE DPP-IV INHIBITOR LINAGLIPTIN FOR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-22 WO disclosed
EP-2114933-B1 PIPERIDINE GPCR AGONISTS PROSIDION LTD (GB) 2011-09-07 EP disclosed
US-20100048632-A1 Piperidine GPCR Agonists PROSIDION LIMITED (GB) 2010-02-25 US disclosed
US-20100048632-A1 Piperidine GPCR Agonists PROSIDION LIMITED (GB) 2010-02-25 US disclosed
US-20100048632-A1 Piperidine GPCR Agonists PROSIDION LIMITED (GB) 2010-02-25 US disclosed
WO-2008081204-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2008-07-10 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 (2 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-20100048632-A1 Piperidine GPCR Agonists GPR119, GPR27, GLP1R GPR119 1/4885KCNH2 1128/4885ACACB 3197/4885
US-20130109703-A1 Combination of a GPR119 Agonist and the DPP-IV Inhibitor Linagliptin for Use in the Treatment of Diabetes and Related Conditions GPR119, DPP4, GLP1R GPR119 1/4885KCNH2 3673/4885ACACB 1754/4885

“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.