SCHEMBL17858645

SCHEMBL17858645

CCN(CCOC)c1ccc(/N=N/c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
TDP1 Q9NUW8 4/20 0.47
MAPK1 P28482 3/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 7/20 0.42
RAB9A P51151 5/20 0.42
KMT2A Q03164 5/20 0.42
NPC1 O15118 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KDM4E B2RXH2 3/20 0.42
LMNA P02545 3/20 0.42
MEN1 O00255 3/20 0.42
MITF O75030 2/20 0.41
PSMD14 O00487 1/20 0.41
CHRNA7 P36544 1/20 0.39
CHRNA10 Q9GZZ6 1/20 0.39
CHRNA9 Q9UGM1 1/20 0.39
CNR2 P34972 1/20 0.39
GSK3B P49841 2/20 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
SCHEMBL18556272 0.88 MAPT (0.44) ALDH1A1TDP1MAPK1TSHRMAPT
SCHEMBL10443160 0.85 TSHR (0.52) ALDH1A1TSHRMAPTRAB9AKMT2A
SCHEMBL13029845 0.84 ALDH1A1 (0.44) ALDH1A1TDP1MAPK1TSHRHSD17B10
Hydrochloric Acid SCHEMBL10625206 0.83 TSHR (0.50) ALDH1A1TSHRMAPTRAB9AKMT2A
SCHEMBL12735263 0.83 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1TSHRHSD17B10
SCHEMBL972448 0.83 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1TSHRHSD17B10
SCHEMBL332067 0.83 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1TSHRHSD17B10
SCHEMBL16016847 0.83 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1TSHRHSD17B10
SCHEMBL29001128 0.83 ALDH1A1 (0.61) ALDH1A1TDP1MAPK1TSHRHSD17B10
SCHEMBL9501656 0.82 CHRNA7 (0.54) ALDH1A1TDP1MAPK1TSHRHSD17B10

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
WO-2016096091-A1 PARTICLES FOR ELECTROPHORETIC DISPLAYS MERCK PATENT GMBH (DE) 2016-06-23 WO disclosed