SCHEMBL21808809

SCHEMBL21808809

N#Cc1ccccc1-c1c2ccccc2c(Br)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.43
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PTGES O14684 2/20 0.39
TSHR P16473 1/20 0.38
IMPDH2 P12268 3/20 0.36
IMPDH1 P20839 2/20 0.36
DYRK1A Q13627 1/20 0.36
USP8 P40818 1/20 0.35
USP7 Q93009 1/20 0.35
PDK2 Q15119 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
PTPN5 P54829 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
LMNA P02545 1/20 0.33
TRPA1 O75762 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
SCHEMBL18889038 0.83 AR (0.45) IMPDH2IMPDH1DYRK1A
SCHEMBL13170780 0.81 ESR2 (0.47) ESR2CA1CA2TSHRGABRG2
SCHEMBL13170778 0.79 CA1 (0.55) ESR2CA1CA2TSHRDYRK1A
SCHEMBL701595 0.79 ALDH1A1 (0.35) TSHR
SCHEMBL29660659 0.76 ALDH1A1 (0.55) ESR2CA1CA2TSHRDYRK1A
SCHEMBL3345245 0.76 ALDH1A1 (0.55) ESR2CA1CA2TSHRDYRK1A
SCHEMBL9005153 0.75 MAOA (0.49) CA1CA2TSHRIMPDH2IMPDH1
SCHEMBL27909137 0.74 ESR2 (0.52) ESR2CA1CA2PTGESTSHR
SCHEMBL11667181 0.74 ESR2 (0.38) ESR2CA1CA2PTGESTSHR
SCHEMBL4264420 0.74 POLB (0.34) TSHRLMNA

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
EP-3754734-B1 ORGANIC LIGHT EMITTING DIODE LG CHEMICAL LTD (KR) 2026-05-27 EP disclosed
CN-112136224-B Organic light emitting diode 株式会社LG化学 2024-08-02 CN disclosed
US-11968892-B2 Organic light emitting device containing a light emitting layer an anthracene derivative, and an organic material layer containing a compound including as sustituents a cyano group and a nitrogen-containing heteroring LG CHEM, LTD. (KR) 2024-04-23 US disclosed
US-20210210694-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-07-08 US disclosed
CN-112136224-A Organic light emitting diode 株式会社LG化学 2020-12-25 CN disclosed
EP-3754734-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2020-12-23 EP disclosed
WO-2020060320-A1 ORGANIC LIGHT EMITTING DIODE 주식회사 엘지화학 2020-03-26 WO disclosed