SCHEMBL19860024

SCHEMBL19860024

Cc1c(F)cccc1-c1c[nH]c2ncc(-c3cnn(C4CCNCC4)c3)cc12

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PAK1 Q13153 12/20 0.72
PAK4 O96013 3/20 0.72
SIK1 P57059 1/20 0.68
SIK3 Q9Y2K2 1/20 0.68
MET P08581 5/20 0.66
PDPK1 O15530 2/20 0.58
ALK Q9UM73 1/20 0.56
PIK3CD O00329 1/20 0.55
PIK3CA P42336 1/20 0.55

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
SCHEMBL15799616 0.89 SIK1 (0.80) PAK1PAK4SIK1SIK3MET
SCHEMBL19860022 0.89 SIK1 (0.79) PAK1PAK4SIK1SIK3MET
SCHEMBL15805359 0.81 SIK1 (1.00) PAK1PAK4SIK1SIK3MET
Hydrochloric Acid SCHEMBL15562407 0.81 MET (0.67) PAK1PAK4SIK1SIK3MET
SCHEMBL15799707 0.81 PAK1 (0.66) PAK1PAK4SIK1SIK3MET
Hydrochloric Acid SCHEMBL15562445 0.80 ALK (0.74) PAK1PAK4SIK1SIK3MET
SCHEMBL15805268 0.80 PAK1 (0.84) PAK1PAK4MET
SCHEMBL19860027 0.79 SIK1 (0.65) PAK1PAK4SIK1SIK3MET
SCHEMBL15562497 0.79 PAK1 (0.68) PAK1PAK4SIK1SIK3MET
Hydrochloric Acid SCHEMBL15562705 0.78 ALK (0.71) PAK1PAK4SIK1SIK3MET

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
US-9890153-B2 Substituted 1H-pyrrolo [2, 3-b] pyridine and 1H-pyrazolo [3, 4-b] pyridine derivatives as salt inducible kinase 2 (SIK2) inhibitors ARRIEN PHARMACEUTICALS LLC (US) 2018-02-13 US disclosed