SCHEMBL16822

SCHEMBL16822

C[C@H]1CN(C(=O)O)CCN1c1ncc(Br)cn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.49
GPR119 Q8TDV5 15/20 0.41
GRM1 Q13255 2/20 0.39
PANK3 Q9H999 1/20 0.38
KCNH2 Q12809 1/20 0.37
SMO Q99835 1/20 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
SCHEMBL18152253 1.00 SLC6A7 (0.49) SLC6A7GPR119GRM1PANK3KCNH2
SCHEMBL18149492 0.89 SLC6A7 (0.46) SLC6A7GPR119GRM1PANK3KCNH2
SCHEMBL18145781 0.89 SLC6A7 (0.46) SLC6A7GPR119GRM1PANK3KCNH2
SCHEMBL18145782 0.89 SLC6A7 (0.46) SLC6A7GPR119GRM1PANK3KCNH2
SCHEMBL5476032 0.86 SLC6A7 (0.49) SLC6A7GPR119GRM1KCNH2SMO
SCHEMBL18150922 0.85 GPR119 (0.44) SLC6A7GPR119GRM1KCNH2
SCHEMBL18150109 0.85 GPR119 (0.44) SLC6A7GPR119GRM1KCNH2
SCHEMBL18150110 0.85 GPR119 (0.44) SLC6A7GPR119GRM1KCNH2
SCHEMBL25232011 0.82 AKR1C3 (0.45) SLC6A7GRM1PANK3SMO
SCHEMBL27233784 0.82 SLC6A7 (0.46) SLC6A7GPR119KCNH2SMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 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 (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-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 SLC6A7 1522/4885GPR119 17/4885GRM1 4001/4885

“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.