SCHEMBL16622233

SCHEMBL16622233

Cc1cc(F)ccc1-c1ncc(-c2ccc(-c3ccccc3)cc2)nc1-c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
PDGFRB P09619 1/20 0.43
KDR P35968 1/20 0.43
FLT3 P36888 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADORA1 P30542 1/20 0.43
TOP1 P11387 2/20 0.42
MAPT P10636 4/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
DHODH Q02127 3/20 0.40
MAPK14 Q16539 2/20 0.40
ABL1 P00519 1/20 0.39

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
SCHEMBL16622246 1.00 RAB9A (0.43) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL16622234 0.94 ADORA1 (0.40) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL16949227 0.88 RAB9A (0.49) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL15256083 0.88 ABL1 (0.41) NPC1ADORA1MEN1KMT2ADHODH
SCHEMBL15256098 0.88 DHODH (0.41) MAPTMEN1KMT2ADHODHMAPK14
SCHEMBL15256079 0.84 TDP1 (0.46) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL16622252 0.83 PDK2 (0.38) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL15256049 0.83 CA12 (0.41) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL15256043 0.83 TDP1 (0.47) RAB9ANPC1PDGFRBKDRFLT3
SCHEMBL16622235 0.83 PDK2 (0.37) RAB9ANPC1PDGFRBKDRFLT3

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