SCHEMBL30368166

SCHEMBL30368166

N#Cc1cccc2c(C#N)c(C=Cc3ccccc3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 3/20 0.40
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PNMT P11086 1/20 0.36
TRPA1 O75762 1/20 0.36
NFE2L2 Q16236 1/20 0.36
IMPDH2 P12268 1/20 0.36
IMPDH1 P20839 1/20 0.36
CHAT P28329 1/20 0.36
SRC P12931 1/20 0.35
PRKCQ Q04759 2/20 0.35

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
Benzene SCHEMBL29106073 0.83 ALDH1A1 (0.44) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL1722260 0.83 ALDH1A1 (0.44) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL1932226 0.83 ALDH1A1 (0.44) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL13952011 0.83 APP (0.40) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL18394373 0.83 IMPDH2 (0.35) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL12091212 0.83 APP (0.40) ALDH1A1HPGDL3MBTL1KDM4ECYP1A2
SCHEMBL325831 0.81 ALDH1A1 (0.50) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL5379049 0.81 ALDH1A1 (0.50) ALDH1A1HPGDALOX12L3MBTL1KDM4E
SCHEMBL12091211 0.80 MAPT (0.39) ALDH1A1HPGDCYP1A2NFE2L2MAOB
SCHEMBL12818757 0.80 APP (0.37) ALDH1A1HPGDALOX12L3MBTL1KDM4E

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
EP-3605612-B1 PIXEL DEFINING LAYER, ORGANIC LIGHT-EMITTING DEVICE AND PREPARATION METHOD THEREOF, AND DISPLAY DEVICE BOE TECHNOLOGY GROUP CO LTD (CN) 2023-05-10 EP disclosed