SCHEMBL2957869

SCHEMBL2957869

CC(CO)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2ccn(C)n2)c1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.75
KCNH2 Q12809 6/20 0.71

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
SCHEMBL29395307 1.00 GCK (0.75) GCKKCNH2
SCHEMBL2659206 1.00 GCK (0.75) GCKKCNH2
Hydrochloric Acid SCHEMBL3604100 0.99 GCK (0.74) GCKKCNH2
SCHEMBL3590591 0.94 GCK (0.67) GCKKCNH2
SCHEMBL2666228 0.92 GCK (0.78) GCKKCNH2
SCHEMBL1146868 0.92 GCK (0.78) GCKKCNH2
SCHEMBL3600334 0.92 GCK (0.74) GCKKCNH2
SCHEMBL3606646 0.92 GCK (0.79) GCKKCNH2
SCHEMBL13255190 0.92 GCK (0.79) GCKKCNH2
SCHEMBL13255193 0.92 GCK (0.74) GCKKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1600442-B1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE MSD KK (JP) 2018-01-17 EP claimed
US-20060167053-A1 Heteroarylcarbamoylbenzene derivative MSD K.K. (JP) 2006-07-27 US claimed
EP-1600442-A1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-30 EP claimed
US-11690841-B2 Glycolysis-activating agents for treatment or prevention of disease QUEEN MARY UNIVERSITY OF LONDON (GB) 2023-07-04 US disclosed
US-20200268750-A1 AGENT QUEEN MARY UNIVERSITY OF LONDON (GB) 2020-08-27 US disclosed
EP-3681496-A1 AGENT Queen Mary University of London (GB) 2020-07-22 EP disclosed
WO-2019053435-A1 AGENT QUEEN MARY UNIVERSITY OF LONDON (GB) 2019-03-21 WO disclosed
EP-1600442-B1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE MSD KK (JP) 2018-01-17 EP disclosed
EP-1600442-B1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE MSD KK (JP) 2018-01-17 EP disclosed
EP-1756076-B1 HETROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2010-08-11 EP disclosed
US-7754743-B2 Heteroarylcarbamoylbenzene derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-07-13 US disclosed
US-20090018056-A1 Heteroarylcarbamoylbenzene derivatives MSD K.K. (JP) 2009-01-15 US disclosed
US-7432287-B2 Heteroarylcarbamoylbenzene derivative BANYU PHARMECEUTICAL CO., LTD. (JP) 2008-10-07 US disclosed
US-20060167053-A1 Heteroarylcarbamoylbenzene derivative MSD K.K. (JP) 2006-07-27 US disclosed
EP-1600442-A1 HETEROARYLCARBAMOYLBENZENE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-30 EP 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 (4 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-20090018056-A1 Heteroarylcarbamoylbenzene derivatives GCK, GCKR, KHK GCK 1/4885KCNH2 470/4885
US-20200268750-A1 AGENT NFATC1, CX3CR1, CD47 GCK 35/4885KCNH2 3747/4885
US-20060167053-A1 Heteroarylcarbamoylbenzene derivative GCK, GCKR, GALK1 GCK 1/4885KCNH2 1033/4885
US-11690841-B2 Glycolysis-activating agents for treatment or prevention of disease HK2, PDK1, HK1 GCK 13/4885KCNH2 3263/4885

“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.