SCHEMBL24924852

SCHEMBL24924852

N#Cc1cccc(-c2nc(-c3cc(C#N)ccc3-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)nc(-c3cc(C#N)ccc3-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 0.43
CYP3A4 P08684 8/20 0.43
ALDH1A1 P00352 6/20 0.43
CYP2D6 P10635 6/20 0.43
CLK4 Q9HAZ1 6/20 0.43
LMNA P02545 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
CYP2C19 P33261 4/20 0.43
TSHR P16473 4/20 0.43
HSD17B10 Q99714 4/20 0.43
MAPK1 P28482 4/20 0.43
CYP2C9 P11712 3/20 0.43
TP53 P04637 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
ALDH1A3 P47895 1/20 0.41
USP2 O75604 4/20 0.40
HIF1A Q16665 2/20 0.40
HRH4 Q9H3N8 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
SCHEMBL24268782 0.98 CYP1A2 (0.43) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL27015796 0.97 CYP1A2 (0.45) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL22916810 0.97 CYP1A2 (0.42) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL20156167 0.97 CYP1A2 (0.44) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL21089887 0.97 CYP1A2 (0.44) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL26513681 0.96 CYP1A2 (0.40) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL26052460 0.96 CYP1A2 (0.42) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL26041356 0.96 CYP1A2 (0.42) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL26052443 0.96 CYP1A2 (0.43) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4
SCHEMBL26052349 0.94 CYP1A2 (0.42) CYP1A2CYP3A4ALDH1A1CYP2D6CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240032420-A1 ORGANIC ELECTROLUMINESCENT DEVICE EMITTING GREEN LIGHT SAMSUNG DISPLAY CO., LTD. (KR) 2024-01-25 US disclosed
US-20230034026-A1 ORGANIC ELECTROLUMINESCENT DEVICE EMITTING GREEN LIGHT SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-02 US disclosed