SCHEMBL14500822

SCHEMBL14500822

CCc1cc2ccc(OC)cc2nc1-c1cc(C)cc(C)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 11/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ GFER P55789 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ MAPK1 P28482 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CLK1 P49759 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ HPGDS O60760 1/20 0.40

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
SCHEMBL14500806 0.89 KDM4E (0.47) GPBAR1ALDH1A1KDM4EMAPK1TSHR
SCHEMBL13647155 0.88 GPBAR1 (0.47) GPBAR1ALDH1A1GFERKDM4EL3MBTL1
SCHEMBL13870800 0.84 KMT2A (0.47) GPBAR1ALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL13647188 0.82 ALDH1A1 (0.43) GPBAR1ALDH1A1GFERKDM4EL3MBTL1
SCHEMBL13647156 0.80 ALDH1A1 (0.46) GPBAR1ALDH1A1GFERKDM4EL3MBTL1
SCHEMBL14500794 0.78 TACR3 (0.51) ALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL14500810 0.77 MAOB (0.45) ALDH1A1KDM4EL3MBTL1MAPK1TSHR
SCHEMBL14500817 0.77 RAB9A (0.43) GPBAR1ALDH1A1GFERKDM4EL3MBTL1
SCHEMBL13647134 0.77 GPBAR1 (0.44) GPBAR1ALDH1A1GFERKDM4EL3MBTL1
SCHEMBL13870806 0.76 PDE3B (0.38) ALDH1A1KDM4ENPSR1HSD17B10MAPT

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 5 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
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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