SCHEMBL33150

SCHEMBL33150

C[C@H]1CN(S(=O)(=O)c2nccs2)CCN1c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCKR Q14397 3/20 0.48
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.39
MAPT P10636 4/20 0.39
JAK2 O60674 1/20 0.39
NAMPT P43490 1/20 0.38
MMP14 P50281 2/20 0.36
ADAMTS5 Q9UNA0 2/20 0.36
GBA1 P04062 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
PTGDR Q13258 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
SCHEMBL12089361 0.87 GCKR (0.54) GCKRLMNASMN1; SMN2
SCHEMBL17638 0.84 GCKR (0.69) GCKR
SCHEMBL12093339 0.84 GCKR (0.69) GCKR
SCHEMBL12078851 0.84 GCKR (0.60) GCKR
SCHEMBL15960 0.84 GCKR (0.60) GCKR
SCHEMBL33149 0.84 GCKR (0.60) GCKR
SCHEMBL18934 0.81 GCK (0.58) GCKR
Trifluoroacetic Acid SCHEMBL22286 0.81 GCKR (0.64) GCKR
SCHEMBL23880 0.81 GCKR (0.50) GCKR
Trifluoroacetic Acid SCHEMBL20635 0.80 GCKR (0.56) GCKR

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 3 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
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 GCKR 1/4885LMNA 4705/4885SMN1; SMN2 4413/4885

“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.