SCHEMBL2124022

SCHEMBL2124022

Cc1nn(CC(F)F)cc1Nc1ncc(F)c(Nc2ccccc2NS(C)(=O)=O)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 4/20 0.57
LRRK2 Q5S007 5/20 0.49
GSK3A P49840 1/20 0.49
MAPK15 Q8TD08 1/20 0.49
CAMKK2 Q96RR4 1/20 0.49
EGFR P00533 5/20 0.41
CYP1A2 P05177 1/20 0.41
AURKA O14965 2/20 0.40
ALK Q9UM73 3/20 0.40
ROS1 P08922 2/20 0.40
STK17B O94768 1/20 0.40
CSF1R P07333 1/20 0.40
IKBKE Q14164 1/20 0.40
AAK1 Q2M2I8 1/20 0.40
ULK3 Q6PHR2 1/20 0.40
NUAK2 Q9H093 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
TBK1 Q9UHD2 1/20 0.40
MET P08581 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
SCHEMBL2125825 0.91 GLO1 (0.51) GLO1LRRK2EGFRALKROS1
SCHEMBL2123461 0.91 GLO1 (0.59) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL2122067 0.88 GLO1 (0.55) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL2121049 0.85 GLO1 (0.62) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL2123175 0.84 GLO1 (0.63) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL656107 0.83 GLO1 (0.78) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL2123700 0.80 ALK (0.57) LRRK2EGFRALKROS1MET
SCHEMBL1707645 0.80 GLO1 (0.73) GLO1LRRK2GSK3AMAPK15CAMKK2
SCHEMBL2124145 0.79 ALK (0.53) GLO1LRRK2EGFRALKROS1
Hydrochloric Acid SCHEMBL1707850 0.79 GLO1 (0.72) GLO1LRRK2GSK3AMAPK15CAMKK2

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-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2012-07-05 US claimed
EP-2443106-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS Cellzome Limited (GB) 2012-04-25 EP claimed
WO-2010146133-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2010-12-23 WO claimed
US-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2012-07-05 US disclosed
EP-2443106-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS Cellzome Limited (GB) 2012-04-25 EP disclosed
WO-2010146133-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS CELLZOME LIMITED (GB) 2010-12-23 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-20120172384-A1 HETEROCYCLYLAMINOPYRIMIDINES AS KINASE INHIBITORS ZAP70, JAK3, JAK2 GLO1 3371/4885LRRK2 1177/4885GSK3A 694/4885

“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.