SCHEMBL5021391

SCHEMBL5021391

c1ccc2c(c1)c1ccccc1n2-c1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccncc32)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAOA P21397 5/20 0.44
MAOB P27338 5/20 0.44
ACHE P22303 1/20 0.44
DYRK1A Q13627 2/20 0.41
SLC6A2 P23975 1/20 0.41
IDO1 P14902 3/20 0.40
CDK4 P11802 1/20 0.39
CDK6 Q00534 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
IKBKB O14920 1/20 0.39
AURKA O14965 1/20 0.39
CHUK O15111 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PIM1 P11309 1/20 0.39
TOP1 P11387 1/20 0.39
GABRA1 P14867 1/20 0.39

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
SCHEMBL16356754 1.00 KDM4E (0.50) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL11910140 0.93 KDM4E (0.52) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL22139282 0.93 KDM4E (0.52) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL14595446 0.92 KDM4E (0.43) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL804490 0.92 KDM4E (0.43) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL16356750 0.89 MAOA (0.56) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL261895 0.89 MAOA (0.56) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL16356751 0.89 MAOA (0.56) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL5021387 0.89 MAOA (0.56) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL15428469 0.89 KDM4E (0.67) KDM4EATML3MBTL1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9240559-B2 Phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2016-01-19 US disclosed
US-9240559-B2 Phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2016-01-19 US disclosed
US-20150236275-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same LG DISPLAY CO., LTD. (KR) 2015-08-20 US disclosed
US-20150236275-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same LG DISPLAY CO., LTD. (KR) 2015-08-20 US disclosed
US-9045471-B2 Phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2015-06-02 US disclosed
US-9045471-B2 Phosphorescent compound and organic electroluminescent device using the same LG DISPLAY CO., LTD. (KR) 2015-06-02 US disclosed
US-20120104371-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same LG DISPLAY CO., LTD. 2012-05-03 US disclosed
US-20120104371-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same LG DISPLAY CO., LTD. 2012-05-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150236275-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same PTH1R, PGLS, PPIP5K2 KDM4E 3639/4885ATM 2438/4885L3MBTL1 3871/4885
US-20120104371-A1 Phosphorescent Compound and Organic Electroluminescent Device Using the Same PTH1R, PGLS, PPIP5K2 KDM4E 3639/4885ATM 2438/4885L3MBTL1 3871/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.