SCHEMBL17053

SCHEMBL17053

O=S(=O)(c1cccs1)N1CCNC(CC2CCOCC2)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCKR Q14397 5/20 0.53
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
PKM P14618 3/20 0.46
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.42
HTT P42858 1/20 0.40
MAPT P10636 2/20 0.40
JAK2 O60674 1/20 0.40

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
Hydrochloric Acid SCHEMBL12078614 0.99 GCKR (0.52) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL17124 0.82 TSHR (0.48) KMT2APOLBALDH1A1TSHRMAPK1
SCHEMBL17416 0.77 ALDH1A1 (0.62) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL16866 0.76 GCKR (0.55) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL16733 0.76 GCKR (0.35) GCKRMEN1KMT2APOLBALDH1A1
Hydrochloric Acid SCHEMBL23483 0.76 GCKR (0.55) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL20111 0.75 PKM (0.59) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL18037 0.75 PKM (0.59) GCKRMEN1KMT2APOLBALDH1A1
SCHEMBL12093378 0.74 PKM (0.44) MEN1KMT2APOLBALDH1A1TSHR
SCHEMBL18608 0.74 GCKR (0.76) GCKRMAPTJAK2

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 5 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-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
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 1/4885MEN1 4072/4885KMT2A 3843/4885

“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.