SCHEMBL24255933

SCHEMBL24255933

c1ccc(-c2ccc(N(c3ccccc3)c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc4n3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 3/20 0.51
SCN9A Q15858 2/20 0.42
ADORA2A P29274 5/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
MTOR P42345 1/20 0.40
PIK3CG P48736 1/20 0.40
ATM Q13315 1/20 0.40
BACE1 P56817 1/20 0.39
ADORA1 P30542 2/20 0.39
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ESR1 P03372 1/20 0.37

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
SCHEMBL23605079 0.90 NUDT1 (0.61) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL24255950 0.89 NUDT1 (0.63) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL21709439 0.89 NUDT1 (0.63) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL23605051 0.85 NUDT1 (0.44) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL24255943 0.84 NUDT1 (0.39) NUDT1SCN9AADORA2AKMT2AKDM4E
SCHEMBL23605426 0.83 NUDT1 (0.45) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL23605049 0.81 NUDT1 (0.50) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL23605059 0.81 NUDT1 (0.50) NUDT1SCN9AADORA2AMEN1KMT2A
SCHEMBL12690622 0.80 L3MBTL1 (0.45) ADORA2AMEN1KMT2APIK3CDPIK3CA
SCHEMBL12146607 0.80 L3MBTL1 (0.49) ADORA2AMEN1KMT2APIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
US-20230337529-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2023-10-19 US disclosed
WO-2022035097-A1 ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER 엘티소재주식회사 2022-02-17 WO disclosed