SCHEMBL2469935

SCHEMBL2469935

CNc1nc(Nc2ccc(OC)c(S(C)(=O)=O)c2)ncc1-c1n[nH]c2cc(F)c(F)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 5/20 0.44
GRM4 Q14833 3/20 0.41
GAK O14976 1/20 0.39
PTK2 Q05397 2/20 0.38
SYK P43405 3/20 0.38
CDK2 P24941 4/20 0.37
CDK9 P50750 1/20 0.37
EGFR P00533 2/20 0.37
ITK Q08881 2/20 0.37
CDK1 P06493 3/20 0.37
KDR P35968 3/20 0.37
JAK2 O60674 2/20 0.37
TYK2 P29597 2/20 0.37
JAK3 P52333 2/20 0.37
CYP1A2 P05177 1/20 0.37
JAK1 P23458 1/20 0.37
PLK4 O00444 1/20 0.37
AURKA O14965 1/20 0.37
PDPK1 O15530 1/20 0.37
DAPK3 O43293 1/20 0.37

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
SCHEMBL14633689 0.89 JAK3 (0.44) LRRK2GRM4SYKCDK2CDK9
SCHEMBL14634005 0.88 LRRK2 (0.42) LRRK2GRM4GAKPTK2SYK
SCHEMBL14634249 0.83 CDK9 (0.40) LRRK2GAKSYKCDK2CDK9
SCHEMBL2469734 0.82 SYK (0.44) LRRK2GAKPTK2SYKCDK2
SCHEMBL14634112 0.82 GRM4 (0.52) LRRK2GRM4GAKITKNTRK1
SCHEMBL14633760 0.80 CCNT1 (0.37) LRRK2SYKCDK2CDK9CDK1
SCHEMBL14634262 0.79 NTRK1 (0.44) LRRK2GRM4SYKCDK2EGFR
SCHEMBL14633931 0.79 JAK3 (0.43) LRRK2GRM4SYKCDK2CDK9
SCHEMBL2466308 0.78 GRM4 (0.41) GRM4SYKCDK2CDK9EGFR
SCHEMBL14633947 0.78 JAK1 (0.39) LRRK2GAKSYKCDK2CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US disclosed
WO-2011120025-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-09-29 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 (2 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-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K20 LRRK2 487/4885GRM4 4019/4885GAK 237/4885
US-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS CDK2, MAP3K19, MAP3K1 LRRK2 599/4885GRM4 3206/4885GAK 85/4885

“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.