SCHEMBL2371745

SCHEMBL2371745

CCCc1nc(N2CCC(CCCOc3ccc(C(=O)N[C@H](C)CO)c(F)c3)CC2)no1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.48
HDAC4 P56524 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HRH3 Q9Y5N1 10/20 0.41
KCNH2 Q12809 1/20 0.39
CRBN Q96SW2 1/20 0.38

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
SCHEMBL2372543 0.89 GPR119 (0.49) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2370835 0.88 GPR119 (0.49) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2567812 0.87 GPR119 (0.48) GPR119KCNH2
SCHEMBL2371476 0.87 GPR119 (0.45) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2215794 0.87 ACACB (0.41) GPR119HDAC4HDAC6HRH3
SCHEMBL1842679 0.84 HRH3 (0.44) GPR119HRH3
SCHEMBL2371717 0.83 GPR119 (0.51) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2372004 0.83 GPR119 (0.51) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2372433 0.83 GPR119 (0.51) GPR119HDAC4HDAC6HRH3KCNH2
SCHEMBL2217491 0.82 HRH3 (0.46) HRH3

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 13 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
EP-2383270-A1 Piperidine GPCR agonists Prosidion Limited (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
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 1/4885HDAC4 1655/4885HDAC6 1533/4885
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 1/4885HDAC4 317/4885HDAC6 2235/4885

“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.