SCHEMBL17877070

SCHEMBL17877070

CC1(C)c2cc(-c3ccccc3[N+](=O)[O-])ccc2-n2c3ccccc3c3cccc1c32

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPT P10636 3/20 0.36
▸ LMNA P02545 3/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DUSP3 P51452 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ GABRA3 P34903 1/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ ACHE P22303 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 1/20 0.33

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
SCHEMBL16138583 0.86 ALDH1A1 (0.40) ALDH1A1TDP1MAPTLMNAMAPK1
SCHEMBL10065484 0.82 ALKBH5 (0.36) ALDH1A1MAPTMAPK1DUSP3MEN1
SCHEMBL20686310 0.80 ALKBH5 (0.34) MAPTMAPK1DUSP3MEN1KMT2A
SCHEMBL22434708 0.80 ALKBH5 (0.34) MAPTMAPK1DUSP3MEN1KMT2A
SCHEMBL16596892 0.79 TUBB4A (0.37) MAPTMAPK1DUSP3MEN1KMT2A
SCHEMBL12165703 0.79 RXRA (0.36) ALDH1A1MAPTMAPK1DUSP3MEN1
SCHEMBL21788335 0.79 DUSP3 (0.33) MAPTMAPK1DUSP3MEN1KMT2A
SCHEMBL30905989 0.77 MEN1 (0.44) ALDH1A1MAPK1DUSP3MEN1KMT2A
SCHEMBL27239726 0.77 MEN1 (0.44) ALDH1A1MAPK1DUSP3MEN1KMT2A
SCHEMBL13964153 0.77 TSPO (0.33) ALDH1A1MAPTLMNAMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9911926-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-06 — — US disclosed
US-20160190475-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20160190475-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20160190473-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20160190473-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20160190474-A1 ORGANIC LIGHT-EMITTING DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
US-20160190474-A1 ORGANIC LIGHT-EMITTING DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 — — US disclosed
Send feedback