SCHEMBL13811892

SCHEMBL13811892

COc1ccc2cc(-c3n[nH]c4ccc(-c5nc(CN6CCN(C(C)=O)CC6)n[nH]5)cc34)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 7/20 0.50
CHEK1 O14757 4/20 0.44
GRK6 P43250 1/20 0.41
LTA4H P09960 1/20 0.41
TTK P33981 1/20 0.40
ITK Q08881 1/20 0.40
CDK7 P50613 1/20 0.39
CLK2 P49760 1/20 0.39
PRKAG1 P54619 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
GSK3B P49841 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
SCHEMBL4084647 0.88 CLK2 (0.46) LRRK2CHEK1TTKITKCDK7
SCHEMBL4085679 0.87 LRRK2 (0.42) LRRK2GRK6TTKITKCLK2
SCHEMBL4084381 0.86 GSK3B (0.46) LRRK2GRK6ITKALDH1A1LMNA
SCHEMBL13811890 0.81 GRK6 (0.46) LRRK2GRK6TTKITKPRKAG1
SCHEMBL4089492 0.79 TTK (0.46) LRRK2CHEK1GRK6TTKITK
SCHEMBL13811889 0.79 HRH3 (0.43) LRRK2ITKCLK2GSK3B
SCHEMBL13812149 0.79 LRRK2 (0.39) LRRK2GRK6TTKITKGAA
SCHEMBL13812153 0.79 GSK3B (0.47) LRRK2TTKCLK2GSK3B
SCHEMBL4083131 0.79 CSNK1D (0.45) CLK2GSK3B
SCHEMBL5817740 0.78 CSNK1D (0.46) CLK2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 LRRK2 553/4885CHEK1 322/4885GRK6 762/4885

“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.