SCHEMBL4864306

SCHEMBL4864306

Fc1ccc(-c2cc(-c3ccc[nH]3)ccn2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 5/20 0.41
KDR P35968 3/20 0.41
PLK4 O00444 1/20 0.41
MAPK13 O15264 1/20 0.41
DAPK3 O43293 1/20 0.41
DYRK3 O43781 1/20 0.41
RPS6KA4 O75676 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
CHEK2 O96017 1/20 0.41
EGFR P00533 1/20 0.41
CDK1 P06493 1/20 0.41
MET P08581 1/20 0.41
PIM1 P11309 1/20 0.41
RPS6KB1 P23443 1/20 0.41
MAPK1 P28482 1/20 0.41
AXL P30530 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK9 P45984 1/20 0.41
CSNK1A1 P48729 1/20 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
SCHEMBL28105602 0.80 KMO (0.50) KMOTGFBR1MEN1NPC1RAB9A
SCHEMBL27801911 0.77 CDK2 (0.43) MEN1KMT2A
SCHEMBL3446347 0.76 ITK (0.47) MAPKAPK2KDRPLK4MAPK13DAPK3
SCHEMBL28114489 0.75 CDK2 (0.42) MEN1KMT2A
SCHEMBL16242291 0.75 KMO (0.47) KMOKDM4CTGFBR1MEN1NPC1
SCHEMBL19072696 0.75 KMO (0.54) MAPK13MAPK12MAPK14KMOKDM4C
SCHEMBL29445848 0.75 KMO (0.54) MAPK13MAPK12MAPK14KMOKDM4C
SCHEMBL3446349 0.74 NR4A2 (0.54) MAP4K4PIM1MAPK1DYRK1ACLK4
SCHEMBL23417018 0.74 IDO1 (0.49) KDRMAPK13MAP4K4MAPK1MAPK12
Pyridine SCHEMBL28089565 0.74 CYP3A4 (0.40) MAPK14KMOKDM4CTGFBR1MEN1

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
US-7320835-B2 Phosphorescent material E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-01-22 US disclosed
US-20050196637-A1 Phosphorescent material LG CHEM, LTD. (KR) 2005-09-08 US disclosed