SCHEMBL16622234

SCHEMBL16622234

Cc1cc(F)ccc1-c1ncc(-c2cccc(-c3ccccc3)c2)nc1-c1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.40
ABL1 P00519 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
MAPK14 Q16539 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 2/20 0.38
PDGFRB P09619 1/20 0.38
KDR P35968 1/20 0.38
FLT3 P36888 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DHODH Q02127 1/20 0.38
TOP1 P11387 1/20 0.38
GRM5 P41594 1/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL16622233 0.94 RAB9A (0.43) ADORA1ABL1TDP1CTDSP1MAPK14
SCHEMBL16622246 0.94 RAB9A (0.43) ADORA1ABL1TDP1CTDSP1MAPK14
SCHEMBL15256083 0.87 ABL1 (0.41) ADORA1ABL1MAPK14NPC1DHODH
SCHEMBL16949227 0.85 RAB9A (0.49) ADORA1TDP1RAB9ANPC1PDGFRB
SCHEMBL16948794 0.83 RAB9A (0.44) ADORA1MAPK14RAB9ANPC1PDGFRB
SCHEMBL15256098 0.82 DHODH (0.41) ABL1MAPK14DHODHGRM5MAPT
SCHEMBL16622235 0.82 PDK2 (0.37) ADORA1ABL1MAPK14RAB9ANPC1
SCHEMBL15256065 0.81 DHODH (0.39) ADORA1MAPK14RAB9ADHODHTOP1
SCHEMBL15256049 0.80 CA12 (0.41) MAPK14RAB9ANPC1PDGFRBKDR
SCHEMBL15256079 0.79 TDP1 (0.46) ADORA1TDP1RAB9ANPC1PDGFRB

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-8999520-B2 Organometallic complex and light emitting element, light emitting device, and electronic device using the organometallic complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-04-07 US disclosed