SCHEMBL14214724

SCHEMBL14214724

Nc1nc2ccccc2n1-c1ncnc(Nc2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 1/20 0.47
SCN9A Q15858 3/20 0.47
KCNH2 Q12809 1/20 0.47
SCN5A Q14524 1/20 0.47
PIK3CA P42336 2/20 0.46
MTOR P42345 2/20 0.46
LCK P06239 2/20 0.46
KDR P35968 2/20 0.46
MAPK14 Q16539 2/20 0.46
CTSC P53634 1/20 0.45
IDH1 O75874 5/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADORA2A P29274 1/20 0.41
ABL1 P00519 2/20 0.41
BCR P11274 2/20 0.41

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
SCHEMBL14214617 0.82 KDR (0.53) NOD1SCN9AKCNH2SCN5APIK3CA
SCHEMBL14214728 0.79 MKNK1 (0.53) SCN9APIK3CAMTORLCKKDR
SCHEMBL14214626 0.78 CDK1 (0.47) PIK3CAMTORLCKKDRMAPK14
SCHEMBL14214621 0.78 KDR (0.57) PIK3CAMTORLCKKDRMAPK14
SCHEMBL16748475 0.78 CHRNA7 (0.51) PIK3CAMTORIDH1MEN1NPC1
SCHEMBL3244139 0.77 PIK3CA (0.55) SCN9AKCNH2SCN5APIK3CAMTOR
SCHEMBL30568377 0.76 SCN9A (0.61) SCN9AKCNH2SCN5ACTSCABL1
SCHEMBL16748516 0.76 CHRNA7 (0.46) PIK3CAMTORIDH1MEN1NPC1
SCHEMBL14214682 0.75 PIK3CA (0.45) PIK3CAMTORLCKKDRMAPK14
SCHEMBL16748444 0.74 BMI1 (0.49) NOD1SCN9AKCNH2SCN5APIK3CA

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-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed