SCHEMBL10380294

SCHEMBL10380294

Cc1cc(-c2cnc(N)c(OC(C)c3ccccc3C)c2)ccc1C(=O)N1CC(C)NC(C)C1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MET P08581 5/20 0.56
LRRK2 Q5S007 1/20 0.41
JAK2 O60674 8/20 0.40
JAK1 P23458 3/20 0.40
TYK2 P29597 3/20 0.40
JAK3 P52333 3/20 0.40
ALK Q9UM73 3/20 0.39
NEK2 P51955 3/20 0.38
PLK1 P53350 2/20 0.38
AURKA O14965 1/20 0.38
CDK2 P24941 1/20 0.38
TTK P33981 1/20 0.38

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
SCHEMBL10270463 0.92 MET (0.66) METJAK2JAK1TYK2JAK3
SCHEMBL10215079 0.92 MET (0.66) METJAK2JAK1TYK2JAK3
SCHEMBL16129605 0.89 MET (0.44) METLRRK2JAK2JAK1TYK2
SCHEMBL10270462 0.85 MET (0.41) METLRRK2JAK2JAK1TYK2
SCHEMBL10215077 0.85 MET (0.41) METLRRK2JAK2JAK1TYK2
SCHEMBL10381874 0.84 MET (0.53) METLRRK2JAK2JAK1TYK2
SCHEMBL10216036 0.82 MET (0.83) METLRRK2JAK2JAK1TYK2
SCHEMBL5496122 0.82 MET (0.65) METJAK2JAK1TYK2JAK3
SCHEMBL30454349 0.80 MET (0.65) METJAK2NEK2PLK1AURKA
SCHEMBL488583 0.80 MET (0.65) METJAK2NEK2PLK1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2476667-A2 Aminoheteroaryl compounds as protein kinase inhibitors Sugen, Inc. (US) 2012-07-18 EP disclosed