SCHEMBL16789905

SCHEMBL16789905

c1ccc(-n2c3ccccc3c3cc4ccc5c6c(ccc(c46)c32)cc2c3ccccc3n(-c3ccccc3)c25)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ ATM Q13315 1/20 0.55
▸ ERBB2 P04626 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ AHR P35869 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ BRCA1 P38398 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPK8 P45983 2/20 0.36
▸ IL1R1 P14778 1/20 0.36
▸ MAPK1 P28482 2/20 0.35
▸ PGR P06401 1/20 0.35

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
SCHEMBL19229841 0.94 L3MBTL1 (0.49) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL16786596 0.91 L3MBTL1 (0.50) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL16001355 0.91 L3MBTL1 (0.46) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL16001353 0.91 L3MBTL1 (0.46) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL14460566 0.90 KDM4E (0.45) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL14460516 0.90 KDM4E (0.45) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL16001351 0.89 KDM4E (0.44) L3MBTL1KDM4EATMERBB2CYP1A2
SCHEMBL19301450 0.87 KDM4E (0.55) L3MBTL1KDM4EATMCYP1A2ALDH1A1
SCHEMBL16001352 0.87 KDM4E (0.41) L3MBTL1KDM4EATMALDH1A1KMT2A
SCHEMBL12873404 0.86 L3MBTL1 (0.59) L3MBTL1KDM4EATMALDH1A1KMT2A

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
US-9825237-B2 Organic electroluminescent element, compound for organic electroluminescent element, and light-emitting device, display device, and illumination device using said element UDC IRELAND LIMITED (IE) 2017-11-21 — — US disclosed
US-9397303-B2 Organic electroluminescent element, material for said element, and light-emitting device, display device, and illumination device using said element UDC IRELAND LIMITED (IE) 2016-07-19 — — US disclosed
US-20150162554-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, MATERIAL FOR SAID ELEMENT, AND LIGHT-EMITTING DEVICE, DISPLAY DEVICE, AND ILLUMINATION DEVICE USING SAID ELEMENT UDC IRELAND LIMITED (IE) 2015-06-11 — — US disclosed
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