SCHEMBL22987002

SCHEMBL22987002

N#Cc1ccc(-c2ccc(-c3ccc(-c4cccc(-c5cc(-c6ccccc6)nc(-c6ccccc6)c5)c4)c4ccccc34)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 0.57
GABRA1 P14867 2/20 0.51
GABRG2 P18507 2/20 0.51
GABRB3 P28472 2/20 0.51
GABRA5 P31644 2/20 0.51
GABRA3 P34903 2/20 0.51
ABCG2 Q9UNQ0 2/20 0.48
ABCB1 P08183 1/20 0.48
ALDH1A3 P47895 2/20 0.45
SQOR Q9Y6N5 3/20 0.45
KDM4E B2RXH2 3/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA1 P30542 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ADORA2A P29274 1/20 0.43
MAPK1 P28482 1/20 0.43
PDK2 Q15119 1/20 0.43
ACP1 P24666 1/20 0.41
HPGD P15428 2/20 0.41

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
SCHEMBL22987034 0.99 MYC (0.55) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987246 0.97 MYC (0.57) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22986973 0.97 MYC (0.57) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987251 0.94 MYC (0.63) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987168 0.94 MYC (0.63) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987244 0.94 MYC (0.63) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987245 0.94 MYC (0.63) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987035 0.94 MYC (0.63) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22987003 0.93 GABRG2 (0.52) MYCGABRA1GABRG2GABRB3GABRA5
SCHEMBL22064683 0.93 MYC (0.59) MYCGABRA1GABRG2GABRB3GABRA5

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
EP-4135005-A1 ORGANIC LIGHT-EMITTING DEVICE SFC Co., Ltd. (KR) 2023-02-15 EP disclosed
US-20210050528-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-02-18 US disclosed