SCHEMBL29478498

SCHEMBL29478498

c1cc2c(cn1)[nH]c1ccncc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 8/20 0.73
ACHE P22303 4/20 0.73
KDM4E B2RXH2 1/20 0.73
GABRP O00591 1/20 0.73
GABRD O14764 1/20 0.73
IKBKB O14920 1/20 0.73
AURKA O14965 1/20 0.73
ALDH1A1 P00352 1/20 0.73
PIM1 P11309 1/20 0.73
TOP1 P11387 1/20 0.73
GABRA1 P14867 1/20 0.73
IDO1 P14902 1/20 0.73
HPGD P15428 1/20 0.73
GABRB1 P18505 1/20 0.73
GABRG2 P18507 1/20 0.73
MAOA P21397 1/20 0.73
MAOB P27338 1/20 0.73
GABRB3 P28472 1/20 0.73
GABRA5 P31644 1/20 0.73
GABRA3 P34903 1/20 0.73

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
SCHEMBL12590220 1.00 CHUK (0.73) CHUKACHEKDM4EGABRPGABRD
SCHEMBL30322777 0.91 CHUK (0.78) CHUKACHEKDM4EGABRPGABRD
SCHEMBL12396541 0.91 CHUK (0.78) CHUKACHEKDM4EGABRPGABRD
SCHEMBL29642993 0.91 ACHE (0.78) CHUKACHEKDM4EGABRPGABRD
SCHEMBL972999 0.91 ACHE (0.78) CHUKACHEKDM4EGABRPGABRD
Carbazole SCHEMBL18684843 0.84 CHUK (1.00) CHUKACHEKDM4EGABRPGABRD
Norharmane SCHEMBL25834 0.84 CHUK (1.00) CHUKACHEKDM4EGABRPGABRD
Norharmane SCHEMBL9486853 0.84 CHUK (1.00) CHUKACHEKDM4EGABRPGABRD
SCHEMBL121401 0.84 ACHE (1.00) CHUKACHEKDM4EGABRPGABRD
Norharmane SCHEMBL29370219 0.84 CHUK (1.00) CHUKACHEKDM4EGABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112390778-B Heteroanthracene derivative, application thereof and organic electroluminescent device 武汉尚赛光电科技有限公司 2022-03-22 CN disclosed