SCHEMBL24790093

SCHEMBL24790093

CC(C)(C)c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5sc5ccccc56)ccc43)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
PPARG P37231 7/20 0.39
TNKS O95271 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PRKDC P78527 3/20 0.37
PPARA Q07869 2/20 0.37
PMM2 O15305 1/20 0.37
MPI P34949 1/20 0.37
PHOSPHO1 Q8TCT1 1/20 0.37
PARP14 Q460N5 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TNF P01375 1/20 0.33
NOD1 Q9Y239 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL15745997 0.99 ALOX5 (0.48) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL781051 0.95 ALOX5 (0.45) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL10165716 0.94 ALOX5 (0.47) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL24791936 0.93 ALOX5 (0.45) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL13829706 0.92 ALOX5 (0.54) ALOX5TNKSTNKS2PRKDCPARP14
SCHEMBL24791925 0.91 ALOX5 (0.47) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL24811790 0.91 ALOX5 (0.46) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL13829525 0.91 ALOX5 (0.56) ALOX5TNKSTNKS2PRKDCPARP14
SCHEMBL13829545 0.90 ALOX5 (0.48) ALOX5PPARGTNKSTNKS2PRKDC
SCHEMBL10165717 0.90 ALOX5 (0.48) ALOX5PPARGTNKSTNKS2PRKDC

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-20240224800-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2024-07-04 US disclosed
US-20240224800-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2024-07-04 US disclosed
WO-2022264638-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2022-12-22 WO disclosed