SCHEMBL13647156

SCHEMBL13647156

CCc1cc2ccc(OC)cc2nc1-c1ccc(C)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ GFER P55789 1/20 0.46
▸ KDM4E B2RXH2 6/20 0.45
▸ GPBAR1 Q8TDU6 4/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ MAPT P10636 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ TSHR P16473 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ CRHR1 P34998 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CASP1 P29466 1/20 0.38
▸ CLK1 P49759 1/20 0.38

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
SCHEMBL14500811 0.90 KDM4E (0.44) ALDH1A1KDM4EMAPTGAATSHR
SCHEMBL14500818 0.85 CYP11B1 (0.43) ALDH1A1GFERKDM4EGPBAR1L3MBTL1
SCHEMBL14500822 0.80 GPBAR1 (0.49) ALDH1A1GFERKDM4EGPBAR1L3MBTL1
SCHEMBL13647155 0.80 GPBAR1 (0.47) ALDH1A1GFERKDM4EGPBAR1L3MBTL1
SCHEMBL14500798 0.77 TACR3 (0.43) ALDH1A1KDM4EL3MBTL1MAPTGAA
SCHEMBL14500802 0.75 KDM4E (0.48) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL14500820 0.74 CTSA (0.41) ALDH1A1KDM4EMAPTNPSR1RXFP1
SCHEMBL16487811 0.73 KMT2A (0.39) ALDH1A1KDM4EL3MBTL1MAPTGAA
SCHEMBL14983351 0.72 ALDH1A1 (0.53) ALDH1A1GFERKDM4EL3MBTL1MAPT
SCHEMBL28191818 0.72 ALDH1A1 (0.55) ALDH1A1GFERKDM4EGPBAR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9023489-B2 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2015-05-05 — — US disclosed
US-9023489-B2 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2015-05-05 — — US disclosed
EP-1783132-B1 Red phosphorescent compounds and organic electromuninescent devices using the same LG DISPLAY CO LTD (KR) 2009-10-14 — — EP disclosed
US-20070104980-A1 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2007-05-10 — — US disclosed
US-20070104980-A1 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2007-05-10 — — US disclosed
EP-1783132-A1 Red phosphorescent compounds and organic electromuninescent devices using the same LG Electronics Inc. (KR) 2007-05-09 — — EP disclosed
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