SCHEMBL17383

SCHEMBL17383

C[C@H]1COCCN1C[C@H]1CN(C(=O)O)CCN1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 7/20 0.33
XIAP P98170 5/20 0.33
ARG1 P05089 2/20 0.31
KCNH2 Q12809 1/20 0.30
LTA4H P09960 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL25395931 0.86 PIK3R1 (0.35) BIRC2XIAP
SCHEMBL12079372 0.83 USP2 (0.43)
SCHEMBL17710 0.83 USP2 (0.43)
SCHEMBL16989 0.83 USP2 (0.43)
SCHEMBL12079373 0.83 USP2 (0.43)
SCHEMBL13733954 0.80 BIRC2 (0.34) BIRC2XIAPKCNH2LTA4HCA12
SCHEMBL13733957 0.80 BIRC2 (0.34) BIRC2XIAPKCNH2LTA4HCA12
SCHEMBL30491779 0.80 BIRC2 (0.34) BIRC2XIAPKCNH2LTA4HCA12
SCHEMBL12078630 0.75 GCKR (0.34) BIRC2XIAPKCNH2CA12CA1
SCHEMBL30491833 0.73 PDK1 (0.36) BIRC2KCNH2CA1CA2CA9

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 BIRC2 2912/4885XIAP 3622/4885ARG1 3590/4885

“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.