SCHEMBL1713343

SCHEMBL1713343

Cc1nc(OCCCC2CCN(c3nc(C(C)C)no3)CC2)ccc1C(=O)N[C@H](C)CO

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.44
GPR183 P32249 1/20 0.39
KCNH2 Q12809 1/20 0.38
ACACB O00763 1/20 0.34
AXL P30530 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
GABRA5 P31644 3/20 0.33

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
SCHEMBL1713055 0.94 GPR119 (0.44) GPR119GPR183KCNH2ACACBGABRA5
SCHEMBL1713423 0.89 GPR119 (0.46) GPR119GPR183KCNH2GABRA5
SCHEMBL1713304 0.88 GPR119 (0.42) GPR119GPR183KCNH2GABRA5
SCHEMBL1713589 0.88 GPR119 (0.42) GPR119GPR183KCNH2GABRA5
SCHEMBL1713322 0.88 GPR119 (0.40) GPR119GPR183KCNH2ACACBGABRA5
SCHEMBL1713324 0.88 GPR119 (0.40) GPR119GPR183KCNH2ACACBGABRA5
SCHEMBL1713347 0.88 GPR119 (0.45) GPR119GPR183KCNH2GABRA5
SCHEMBL3315647 0.88 GPR119 (0.45) GPR119GPR183KCNH2HDAC4GABRA5
SCHEMBL1713350 0.88 GPR119 (0.45) GPR119GPR183KCNH2GABRA5
SCHEMBL1713018 0.88 GPR119 (0.47) GPR119GPR183KCNH2

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
EP-2114935-B1 PIPERIDINE GPCR AGONISTS PROSIDION LTD (GB) 2011-07-20 EP claimed
US-20100105732-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-04-29 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
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-2377864-A1 Piperidine GPCR agonists Prosidion Limited (GB) 2011-10-19 EP disclosed
EP-2114935-B1 PIPERIDINE GPCR AGONISTS PROSIDION LTD (GB) 2011-07-20 EP disclosed
US-20100105732-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-04-29 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 (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-20100105732-A1 PIPERIDINE GPCR AGONISTS GPR119, GPR27, GLP1R GPR119 1/4885GPR183 45/4885KCNH2 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 1/4885GPR183 62/4885KCNH2 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.