SCHEMBL13147443

SCHEMBL13147443

c1ccc(-c2c3ccccc3c(-c3ccc4c(ccc5ccccc54)c3)c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ATM Q13315 1/20 0.46
KMT2A Q03164 2/20 0.40
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
HSD17B1 P14061 3/20 0.37
HSD17B2 P37059 3/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2B6 P20813 2/20 0.37
CYP2C19 P33261 2/20 0.37
PTGER4 P35408 1/20 0.35
IL1R1 P14778 1/20 0.35
TSPO P30536 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HIF1A Q16665 1/20 0.34
CYP1B1 Q16678 1/20 0.34

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
SCHEMBL13147533 0.95 L3MBTL1 (0.51) L3MBTL1KDM4EATMKMT2ACYP1A2
SCHEMBL13147459 0.92 L3MBTL1 (0.49) L3MBTL1KDM4EATMKMT2ACYP1A2
SCHEMBL17718060 0.91 KDM4E (0.45) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL9890890 0.91 KDM4E (0.44) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL13669244 0.91 KDM4E (0.47) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL11910815 0.91 KDM4E (0.47) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL11910826 0.91 KDM4E (0.42) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL13669206 0.91 KDM4E (0.50) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL11910807 0.91 KDM4E (0.50) L3MBTL1KDM4EATMKMT2AESR1
SCHEMBL10130151 0.91 L3MBTL1 (0.50) L3MBTL1KDM4EATMKMT2AESR1

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-2010114256-A2 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME DOW ADVANCED DISPLAY MATERIALS,LTD. (KR) 2010-10-07 WO disclosed