SCHEMBL16622240

SCHEMBL16622240

Cc1ccccc1-c1ncc(-c2ccc(-c3ccccc3)cc2)nc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.47
NPC1 O15118 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDR P35968 2/20 0.47
PDGFRB P09619 1/20 0.47
FLT3 P36888 1/20 0.47
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
DPP4 P27487 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39
ADORA2A P29274 2/20 0.39
LCK P06239 1/20 0.38
JAK3 P52333 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL15256055 0.97 RAB9A (0.50) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL15256076 0.91 NPC1 (0.41) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16622253 0.90 NPC1 (0.44) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16622238 0.88 NR3C1 (0.43) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16948795 0.88 RAB9A (0.47) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16622258 0.88 ATR (0.44) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16949235 0.85 NR1H4 (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL28019522 0.85 RAB9A (0.51) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16622239 0.84 MAOB (0.42) RAB9ANPC1SMN1; SMN2KDRPDGFRB
SCHEMBL16949242 0.84 ALOX5AP (0.37) RAB9ANPC1SMN1; SMN2KDRPDGFRB

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