SCHEMBL2479347

SCHEMBL2479347

N#Cc1cccc(-c2n[nH]c(S)c2-c2ccncc2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 8/20 0.46
CLK4 Q9HAZ1 1/20 0.43
CDC7 O00311 1/20 0.43
MAPK14 Q16539 3/20 0.42
IDO1 P14902 2/20 0.42
MAOB P27338 1/20 0.42
GRM5 P41594 1/20 0.41
TDO2 P48775 1/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MAPK11 Q15759 2/20 0.39
MAPK13 O15264 1/20 0.39
RAF1 P04049 1/20 0.39
MAPK12 P53778 1/20 0.39

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
SCHEMBL2479766 0.80 MAPK14 (0.44) LRRK2CLK4CDC7MAPK14IDO1
SCHEMBL2478461 0.76 MAPK14 (0.54) CLK4CDC7MAPK14MAPK11MAPK13
SCHEMBL31588133 0.75 CLK4 (0.61) CLK4CDC7IDO1MAOBGRM5
SCHEMBL301751 0.75 CLK4 (0.61) CLK4CDC7IDO1MAOBGRM5
SCHEMBL2476444 0.74 ALOX5 (0.49) CDC7MAPK14IDO1
SCHEMBL1847072 0.73 CLK4 (0.45) LRRK2CLK4CDC7MAPK14IDO1
SCHEMBL14519398 0.70 MAPK11 (0.52) MAPK14MAPK11MAPK13RAF1MAPK12
SCHEMBL13977114 0.70 CDC7 (0.59) CLK4CDC7MAPK14IDO1MAOB
SCHEMBL14519632 0.70 MAPK14 (0.56) CLK4MAPK14MAPK11MAPK13RAF1
SCHEMBL2374955 0.69 KMT2A (0.49) CLK4IDO1GRM5

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-8524707-B2 Bicyclic pyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-03 US disclosed
EP-2373664-B1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 EP disclosed
US-20110257165-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-10-20 US disclosed
EP-2373664-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2011-10-12 EP disclosed
WO-2010070060-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-06-24 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-20110257165-A1 BICYCLIC PYRAZOLES AS PROTEIN KINASE INHIBITORS MAP3K19, MAP4K3, MAP3K15 LRRK2 659/4885CLK4 345/4885CDC7 255/4885

“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.