SCHEMBL2015151

SCHEMBL2015151

NCCc1cc2ncccc2nc1-c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.45
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
TAAR1 Q96RJ0 4/20 0.43
ADORA2A P29274 2/20 0.42
DPP4 P27487 1/20 0.40
PTGDR2 Q9Y5Y4 3/20 0.37
MAPK14 Q16539 1/20 0.36
TBXA2R P21731 1/20 0.36
PTGDR Q13258 1/20 0.36
CLK4 Q9HAZ1 2/20 0.36
MAP4K4 O95819 2/20 0.36
CDC7 O00311 1/20 0.36
ROCK2 O75116 1/20 0.36
PIM1 P11309 1/20 0.36
PRKACA P17612 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3B P49841 1/20 0.36
HIPK2 Q9H2X6 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36

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
SCHEMBL9952652 0.90 BCHE (0.46) SYKBCHEACHETAAR1ADORA2A
SCHEMBL1989290 0.90 MAPK14 (0.38) SYKBCHEACHETAAR1MAPK14
SCHEMBL2015255 0.87 BCHE (0.44) SYKBCHEACHEADORA2APTGDR2
SCHEMBL1989452 0.84 BCHE (0.46) SYKBCHEACHEADORA2APTGDR2
SCHEMBL3911088 0.81 TAAR1 (0.50) SYKBCHEACHETAAR1ADORA2A
SCHEMBL19331478 0.80 TAAR1 (0.47) TAAR1ADORA2ADPP4PTGDR2TBXA2R
SCHEMBL12629115 0.80 ADORA2A (0.50) SYKBCHEACHETAAR1ADORA2A
SCHEMBL4434201 0.79 ADORA2A (0.47) TAAR1ADORA2ADPP4PTGDR2USP2
SCHEMBL1990582 0.77 BCHE (0.44) SYKBCHEACHEADORA2AMAPK14
SCHEMBL1988633 0.77 BCHE (0.44) BCHEACHEADORA2AMAPK14CLK4

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-2513109-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2012-10-24 EP disclosed
WO-2011075628-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-06-23 WO disclosed