SCHEMBL5576443

SCHEMBL5576443

CC(C)c1cc(-c2ccccc2)c(-n2ccnc2-c2ccc(F)cc2)c(-c2ccccc2)c1.[Ir]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 0.38
PLK2 Q9NYY3 2/20 0.38
ATP1A1 P05023 1/20 0.38
ATP1B1 P05026 1/20 0.38
ATP1A3 P13637 1/20 0.38
ATP1B2 P14415 1/20 0.38
ATP1A2 P50993 1/20 0.38
ATP1B3 P54709 1/20 0.38
FXYD2 P54710 1/20 0.38
ATP1A4 Q13733 1/20 0.38
KDR P35968 10/20 0.37
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36
METAP2 P50579 1/20 0.36
FLT1 P17948 4/20 0.36
FLT4 P35916 4/20 0.36
STAT1 P42224 1/20 0.36
PLK1 P53350 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35

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
SCHEMBL3825222 0.99 TOP1 (0.39) TOP1PLK2ATP1A1ATP1B1ATP1A3
SCHEMBL26168531 0.91 MAPK9 (0.42) KDRMAPK9MAPK10METAP2FLT1
SCHEMBL12797952 0.86 FFAR1 (0.37) TOP1ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL3817469 0.85 CYP17A1 (0.39) PLK2ATP1A1ATP1B1ATP1A3ATP1B2
SCHEMBL3821581 0.85 TOP1 (0.45) TOP1KDRMAPK9MAPK10FLT1
SCHEMBL3816909 0.82 TOP1 (0.42) TOP1KDRFLT1FLT4
SCHEMBL12797947 0.81 METAP2 (0.39) KDRMAPK9MAPK10METAP2FLT1
SCHEMBL22370024 0.78 MAPK9 (0.42) KDRMAPK9MAPK10FLT1FLT4
SCHEMBL20375745 0.78 CLK4 (0.40)
SCHEMBL12797971 0.76 KDR (0.43) KDRMAPK9MAPK10FLT1FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902374-B2 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2011-03-08 US disclosed
US-20070088167-A1 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION 2007-04-19 US disclosed
US-20060251923-A1 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION 2006-11-09 US disclosed