SCHEMBL2662227

SCHEMBL2662227

CC(C)S(=O)(=O)c1cc(OCCc2ccccn2)c2[nH]nc(Nc3nccs3)c2c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GRM4 Q14833 1/20 0.36
ALDH1A1 P00352 3/20 0.34
PKM P14618 2/20 0.34
RIPK2 O43353 1/20 0.34
SCN8A Q9UQD0 3/20 0.33
ALK Q9UM73 1/20 0.33
SCN1A P35498 2/20 0.33
SCN5A Q14524 2/20 0.33
SCN9A Q15858 6/20 0.33
GCK P35557 1/20 0.33
MAPK1 P28482 1/20 0.32

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
SCHEMBL2668292 0.86 MEN1 (0.35) MEN1KMT2ARIPK2
SCHEMBL2668101 0.85 GRM4 (0.37) KMT2AGRM4ALDH1A1PKMALK
SCHEMBL2668191 0.85 GRM4 (0.37) MEN1KMT2AGRM4ALDH1A1PKM
SCHEMBL16495317 0.84 SCN9A (0.42) MEN1KMT2AGRM4ALDH1A1PKM
SCHEMBL2660971 0.84 MEN1 (0.34) MEN1KMT2AALDH1A1RIPK2GCK
SCHEMBL2668201 0.84 RIPK2 (0.34) MEN1KMT2AGRM4ALDH1A1PKM
SCHEMBL2661771 0.82 MEN1 (0.36) MEN1KMT2AALDH1A1PKM
SCHEMBL16508795 0.82 GCK (0.38) MEN1KMT2AGRM4ALDH1A1PKM
SCHEMBL16495167 0.82 SCN1A (0.47) PKMRIPK2SCN8ASCN1ASCN5A
Hydrochloric Acid SCHEMBL16495393 0.81 GCK (0.38) MEN1KMT2AGRM4ALDH1A1PKM

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-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-08 US disclosed
US-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-12-08 US disclosed
EP-2157859-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE Takeda Pharmaceutical Company Limited (JP) 2010-03-03 EP disclosed
WO-2008156757-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-24 WO disclosed
WO-2008156757-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-24 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-20110301155-A1 INDAZOLE COMPOUNDS FOR ACTIVATING GLUCOKINASE GCKR, GCK, KHK MEN1 4723/4885KMT2A 2280/4885GRM4 2714/4885

“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.