SCHEMBL25756859

SCHEMBL25756859

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c3ccccc3n(-c3ccccc3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
PPARG P37231 4/20 0.42
PPARA Q07869 2/20 0.40
KIF11 P52732 3/20 0.40
PGR P06401 2/20 0.39
RORA P35398 1/20 0.39
RORC P51449 1/20 0.39
RORB Q92753 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
DNMT1 P26358 3/20 0.36
MAT2A P31153 1/20 0.36
MAPK8 P45983 1/20 0.35
KMT2A Q03164 1/20 0.35
NOTUM Q6P988 1/20 0.35
CYP1A2 P05177 1/20 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
SCHEMBL17774081 0.99 KDM4E (0.51) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL23331192 0.97 KDM4E (0.47) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL2604397 0.97 KDM4E (0.47) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL16171497 0.95 KDM4E (0.47) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL15445762 0.95 KDM4E (0.47) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL8739914 0.94 KDM4E (0.56) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL8739923 0.94 KDM4E (0.56) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL15746001 0.94 KDM4E (0.56) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL16940887 0.94 KDM4E (0.56) KDM4EATML3MBTL1PPARGPPARA
SCHEMBL26049183 0.94 KDM4E (0.56) KDM4EATML3MBTL1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024135278-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2024-06-27 WO disclosed
US-20230276644-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-08-31 US disclosed
US-20230276644-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-08-31 US disclosed
EP-4206301-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2023-07-05 EP disclosed