SCHEMBL24905484

SCHEMBL24905484

N#Cc1cccc2c1-c1c(-c3cccc(-c4cccc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3)cccc1C21c2ccccc2Oc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 4/20 0.35
GABRB3 P28472 4/20 0.35
GABRA5 P31644 3/20 0.35
GABRA3 P34903 3/20 0.35
KDM4E B2RXH2 3/20 0.34
HPGD P15428 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HTT P42858 1/20 0.33
ADORA1 P30542 4/20 0.33
ADORA2A P29274 3/20 0.33
PDK2 Q15119 1/20 0.33
USP30 Q70CQ3 1/20 0.32
THRB P10828 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32

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
SCHEMBL24905778 0.96 GABRG2 (0.35) GABRG2GABRB3GABRA5GABRA3KDM4E
SCHEMBL24905471 0.94 MEN1 (0.36) GABRG2GABRB3GABRA5GABRA3KDM4E
SCHEMBL24905505 0.94 PDK2 (0.34) GABRG2GABRB3GABRA5GABRA3ALDH1A1
SCHEMBL24905752 0.93 PDK2 (0.33) GABRG2GABRB3GABRA5GABRA3ALDH1A1
SCHEMBL21702147 0.93 MEN1 (0.36) GABRG2GABRB3GABRA5GABRA3KDM4E
SCHEMBL24905416 0.93 PDK2 (0.34) GABRG2GABRB3GABRA5GABRA3ALDH1A1
SCHEMBL24905506 0.91 HTT (0.33) GABRG2GABRB3GABRA5GABRA3KDM4E
SCHEMBL24905756 0.90 HTT (0.33) GABRG2GABRB3GABRA5GABRA3NPSR1
SCHEMBL23256623 0.89 MEN1 (0.33) GABRG2GABRB3GABRA5GABRA3KDM4E
SCHEMBL21701964 0.88 GABRG2 (0.37) GABRG2GABRB3GABRA5GABRA3KDM4E

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed