SCHEMBL18174741

SCHEMBL18174741

Cc1ccnc(-c2cccc(-c3c4ccccc4c(-c4ccc(-c5ccnc(C)c5)cc4)c4ccccc34)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.43
PSEN1 P49768 4/20 0.41
PSEN2 P49810 4/20 0.41
APH1B Q8WW43 4/20 0.41
NCSTN Q92542 4/20 0.41
APH1A Q96BI3 4/20 0.41
PSENEN Q9NZ42 4/20 0.41
DYRK1A Q13627 1/20 0.41
WNT3A P56704 6/20 0.40
UHRF1 Q96T88 1/20 0.40
CCR1 P32246 1/20 0.40
CCR5 P51681 1/20 0.40
CCR8 P51685 1/20 0.40
LRRK2 Q5S007 1/20 0.39
PORCN Q9H237 1/20 0.39
TGFBR1 P36897 2/20 0.39
MAP4K4 O95819 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
SCHEMBL18174655 0.92 DYRK1A (0.45) CYP2A6PSEN1PSEN2APH1BNCSTN
SCHEMBL18174738 0.89 DYRK1A (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18174722 0.88 WNT3A (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18174577 0.88 CYP2A6 (0.54) CYP2A6UHRF1CCR1CCR5CCR8
SCHEMBL18174580 0.87 CYP2A6 (0.46) CYP2A6CCR1CCR5CCR8TGFBR1
SCHEMBL15160979 0.85 PSEN1 (0.50) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18174734 0.85 CYP3A4 (0.43) CYP2A6PSEN1PSEN2APH1BNCSTN
SCHEMBL15161099 0.85 DYRK1A (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10032893 0.85 CYP2A6 (0.43) CYP2A6CCR1CCR5CCR8TGFBR1
SCHEMBL18174720 0.85 TGFBR1 (0.43) CYP2A6PSEN1PSEN2APH1BNCSTN

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