SCHEMBL2661024

SCHEMBL2661024

CC(C)Sc1ccc2[nH]nc(N)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.50
PDPK1 O15530 3/20 0.50
TYK2 P29597 4/20 0.44
JAK3 P52333 4/20 0.44
ROCK1 Q13464 4/20 0.44
CLK4 Q9HAZ1 4/20 0.44
PRKD3 O94806 3/20 0.44
PLK4 O00444 3/20 0.44
DAPK3 O43293 3/20 0.44
DYRK3 O43781 3/20 0.44
ROCK2 O75116 3/20 0.44
MAP4K4 O95819 3/20 0.44
CDK1 P06493 3/20 0.44
CDK2 P24941 3/20 0.44
MARK3 P27448 3/20 0.44
CLK2 P49760 3/20 0.44
LIMK1 P53667 3/20 0.44
CDK5 Q00535 3/20 0.44
PRKCD Q05655 3/20 0.44
DYRK1A Q13627 3/20 0.44

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
SCHEMBL2661665 0.80 JAK2 (0.47) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL2662003 0.76 GSK3B (0.43) JAK2TYK2JAK3CLK4PRKD3
SCHEMBL2661889 0.74 JAK2 (0.55) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL16934640 0.73 JAK2 (0.58) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL16936129 0.71 NTRK1 (0.55) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL3657599 0.71 JAK2 (0.60) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL29521013 0.71 JAK2 (0.60) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL10213929 0.70 JAK2 (0.81) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL118573 0.70 JAK2 (0.64) JAK2PDPK1TYK2JAK3ROCK1
SCHEMBL2661165 0.70 BTK (0.51) JAK2PDPK1

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 6 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
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 JAK2 655/4885PDPK1 435/4885TYK2 136/4885

“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.