SCHEMBL18174728

SCHEMBL18174728

Cc1cc(-c2ccc(-c3c4ccccc4c(-c4cccc(-c5ccncc5C)c4)c4ccccc34)cc2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.43
NFATC1 O95644 1/20 0.43
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
WNT3A P56704 3/20 0.41
PIK3CA P42336 2/20 0.40
PDE10A Q9Y233 1/20 0.40
PORCN Q9H237 2/20 0.38
LRRK2 Q5S007 2/20 0.38
BRD4 O60885 1/20 0.37
CDC7 O00311 1/20 0.37
ROCK2 O75116 1/20 0.37
MAP4K4 O95819 1/20 0.37
CDK2 P24941 1/20 0.37
GSK3B P49841 1/20 0.37
CLK4 Q9HAZ1 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
SCHEMBL18174717 0.96 PIK3CA (0.41) DYRK1ANFATC1PSEN1PSEN2APH1B
SCHEMBL18174647 0.93 DYRK1A (0.44) DYRK1ANFATC1PSEN1PSEN2APH1B
SCHEMBL18174718 0.91 CYP17A1 (0.44) DYRK1ANFATC1PSEN1PSEN2APH1B
SCHEMBL18174753 0.89 PIK3CA (0.45) DYRK1APIK3CALRRK2MAP4K4CDK2
SCHEMBL15160979 0.87 PSEN1 (0.50) DYRK1APSEN1PSEN2APH1BNCSTN
SCHEMBL18174750 0.87 GRM4 (0.43) DYRK1ABRD4MAP4K4CDK2GSK3B
SCHEMBL15161068 0.87 GRM4 (0.37) PIK3CABRD4CLK4IRAK4
SCHEMBL15161092 0.87 CYP17A1 (0.47) DYRK1ANFATC1PSEN1PSEN2APH1B
SCHEMBL18174756 0.87 NFATC1 (0.44) DYRK1ANFATC1WNT3APIK3CAPDE10A
SCHEMBL18174779 0.87 DYRK1A (0.41) DYRK1ANFATC1PSEN1PSEN2APH1B

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