SCHEMBL18174733

SCHEMBL18174733

Cc1cc(-c2ccc(-c3c4ccccc4c(-c4cccc(-c5cccnc5C)c4)c4ccccc34)cc2)ccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.41
PSEN1 P49768 5/20 0.41
PSEN2 P49810 5/20 0.41
APH1B Q8WW43 5/20 0.41
NCSTN Q92542 5/20 0.41
APH1A Q96BI3 5/20 0.41
PSENEN Q9NZ42 5/20 0.41
DYRK1A Q13627 1/20 0.40
TDO2 P48775 2/20 0.40
DHODH Q02127 1/20 0.40
PDK2 Q15119 1/20 0.39
MKNK2 Q9HBH9 2/20 0.38
CDC7 O00311 1/20 0.38
ROCK2 O75116 1/20 0.38
MAP4K4 O95819 1/20 0.38
CDK2 P24941 1/20 0.38
GSK3B P49841 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
WNT3A P56704 3/20 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
SCHEMBL15161058 0.96 DHODH (0.43) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL18174670 0.92 DHODH (0.45) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL18174738 0.88 DYRK1A (0.50) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL18174565 0.87 DHODH (0.45) TDO2DHODHMKNK2CDC7ROCK2
SCHEMBL18174768 0.86 PDK2 (0.43) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL18174796 0.86 DHODH (0.46) LRRK2DYRK1ATDO2DHODHPDK2
SCHEMBL18174744 0.86 DHODH (0.40) TDO2DHODHPDK2MKNK2CDC7
SCHEMBL15160994 0.86 DHODH (0.44) TDO2DHODHMKNK2CDC7ROCK2
SCHEMBL15160979 0.84 PSEN1 (0.50) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL15161043 0.84 PSEN1 (0.35) LRRK2PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed