SCHEMBL12089014

SCHEMBL12089014

C[C@@H]1CN(c2ccc(C(C)(C)O)cc2)CCN1S(=O)(=O)c1cccs1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCKR Q14397 11/20 0.79
GCK P35557 2/20 0.52
HSD11B1 P28845 3/20 0.49
MAPT P10636 2/20 0.47
JAK2 O60674 1/20 0.47
MAPK1 P28482 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL12089566 1.00 GCKR (0.79) GCKRGCKHSD11B1MAPTJAK2
SCHEMBL16134 0.89 GCKR (1.00) GCKRGCK
SCHEMBL15888 0.89 GCKR (1.00) GCKRGCK
SCHEMBL12089195 0.87 GCKR (0.62) GCKRGCKMAPTJAK2MAPK1
SCHEMBL12088871 0.82 GCKR (0.74) GCKRGCKMAPTJAK2MAPK1
SCHEMBL12088862 0.78 GCKR (0.79) GCKRGCK
SCHEMBL16524 0.75 GCKR (0.77) GCKRGCK
SCHEMBL5320715 0.72 GCKR (0.52) GCKRMAPTMEN1KMT2A
SCHEMBL15854 0.72 GCKR (0.81) GCKRGCKMAPTJAK2MAPK1
SCHEMBL33152 0.72 GCKR (0.81) GCKRGCKMAPTJAK2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 GCKR 1/4885GCK 2/4885HSD11B1 1443/4885

“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.