SCHEMBL13303896

SCHEMBL13303896

C1=Cc2c(c3ccccc3n2-c2c3ccccc3c(-n3c4c(c5ccccc53)CCC=C4)c3ccccc23)CC1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ACHE P22303 3/20 0.32
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ CREBBP Q92793 1/20 0.31
▸ ALOX15 P16050 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ MAOA P21397 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ MAPT P10636 1/20 0.30

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
SCHEMBL12648877 0.97 KDM4E (0.36) KDM4EATML3MBTL1ACHECA1
SCHEMBL23894607 0.90 KMT2A (0.34) KDM4EATML3MBTL1HTR2AHTR2C
SCHEMBL13863781 0.88 KDM4E (0.37) KDM4EATML3MBTL1HTR2AHTR2C
SCHEMBL12939244 0.87 L3MBTL1 (0.48) KDM4EATML3MBTL1MAPK1CYP1A2
SCHEMBL13862509 0.87 KDM4E (0.32) KDM4EATML3MBTL1ACHE
SCHEMBL13352624 0.86 TSPO (0.30) —
SCHEMBL13368921 0.86 TSPO (0.30) —
SCHEMBL24735875 0.85 ALDH1A1 (0.31) KDM4EATML3MBTL1
SCHEMBL17636106 0.85 IMPDH2 (0.35) KDM4ECA1CA2MAPT
SCHEMBL23188707 0.85 ALDH1A1 (0.38) KDM4EATML3MBTL1ACHECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010064871-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2010-06-10 — — WO disclosed
EP-2182002-A1 Novel compounds for electronic material and organic electronic device using the same Gracel Display Inc. (KR) 2010-05-05 — — EP disclosed
EP-2066150-A1 Novel red electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-06-03 — — EP disclosed
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