SCHEMBL7092069

SCHEMBL7092069

COc1ccc(-c2n[nH]c3ccc(-c4cnn[nH]4)cc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAG1 P54619 1/20 0.48
PRKAA1 Q13131 1/20 0.48
PRKAB1 Q9Y478 1/20 0.48
LRRK2 Q5S007 4/20 0.45
DYRK1A Q13627 3/20 0.44
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
TTK P33981 2/20 0.44
ITK Q08881 2/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 2/20 0.42
MKNK1 Q9BUB5 1/20 0.42
MAP2K4 P45985 1/20 0.42
MAPKAPK2 P49137 1/20 0.42
MAPKAPK3 Q16644 1/20 0.42
MAPK6 Q16659 1/20 0.42

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
SCHEMBL5020205 0.80 SCN4A (0.55) DYRK1AGSK3AGSK3BKMT2AMAPK1
SCHEMBL7090587 0.80 MAP2K4 (0.40) DYRK1AGSK3BTTKMAPK1MKNK1
SCHEMBL8251865 0.77 MAP2K4 (0.68) PRKAG1PRKAA1PRKAB1DYRK1AGSK3A
SCHEMBL5382842 0.76 PRKAG1 (0.48) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A
SCHEMBL4009086 0.76 AXL (0.55) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A
Hydrochloric Acid SCHEMBL5390659 0.75 AXL (0.53) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A
SCHEMBL8268311 0.75 PRKAG1 (0.49) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A
SCHEMBL5386179 0.74 GSK3B (0.52) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A
SCHEMBL4736181 0.73 NTRK1 (0.56) LRRK2DYRK1AGSK3AGSK3BTTK
SCHEMBL5385898 0.73 LRRK2 (0.59) PRKAG1PRKAA1PRKAB1LRRK2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313711-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2003-05-28 EP disclosed
WO-2002010137-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2002-02-07 WO disclosed