SCHEMBL2371229

SCHEMBL2371229

CCc1noc(N2CCC(CCCOc3ccc(C(=O)N[C@H](C)CO)c(C)c3)CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.40
HRH3 Q9Y5N1 5/20 0.38
KCNH2 Q12809 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
ACACB O00763 1/20 0.34

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
SCHEMBL2371743 0.93 GPR119 (0.38) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2372270 0.93 GPR119 (0.37) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL12513050 0.92 NPC1 (0.39) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2371581 0.90 GPR119 (0.48) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2372318 0.90 GPR119 (0.48) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2372246 0.89 GPR119 (0.38) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2371714 0.88 GPR119 (0.39) GPR119RAB9ANPC1
SCHEMBL2372154 0.87 GPR119 (0.36) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL2371088 0.87 HRH3 (0.37) GPR119HRH3KCNH2RAB9ANPC1
SCHEMBL1843812 0.86 LMNA (0.40) GPR119RAB9ANPC1DRD2HTR2A

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 11 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
US-20100022591-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-28 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-2114931-B1 PIPERIDINE GPCR AGONISTS PROSIDION LTD (GB) 2011-11-02 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
US-20100022591-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-28 US disclosed
US-20100022591-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-28 US disclosed
WO-2008081205-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-20100022591-A1 PIPERIDINE GPCR AGONISTS GPR119, GPR27, GLP1R GPR119 1/4885HRH3 432/4885KCNH2 1128/4885
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 1/4885HRH3 1151/4885KCNH2 3673/4885

“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.