SCHEMBL21365742

SCHEMBL21365742

CC1(C)c2ccccc2-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccccc4)cc3)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HDAC4 P56524 1/20 0.37
▸ TSPO P30536 4/20 0.35
▸ PTGER4 P35408 1/20 0.34
▸ GSK3B P49841 1/20 0.32
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32
▸ CDC42 P60953 1/20 0.32
▸ RAC1 P63000 1/20 0.32
▸ PGR P06401 2/20 0.32
▸ NPY5R Q15761 1/20 0.31
▸ AKR1C4 P17516 1/20 0.31
▸ AKR1C3 P42330 1/20 0.31
▸ AKR1C2 P52895 1/20 0.31
▸ AKR1C1 Q04828 1/20 0.31
▸ PDK2 Q15119 1/20 0.31
▸ KMT2A Q03164 1/20 0.30
▸ IL1R1 P14778 1/20 0.30

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
SCHEMBL22901776 0.96 PGR (0.33) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL21365519 0.94 KDM4E (0.35) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL21365749 0.93 KDM4E (0.40) KDM4EATML3MBTL1HDAC4GSK3B
SCHEMBL17178643 0.93 KDM4E (0.43) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL22078821 0.90 KDM4E (0.37) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL22901600 0.89 PGR (0.33) KDM4EATML3MBTL1HDAC4PGR
SCHEMBL19652767 0.89 TSPO (0.37) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL19653532 0.88 KDM4E (0.38) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL21365752 0.88 KDM4E (0.35) KDM4EATML3MBTL1HDAC4PDK2
SCHEMBL17759871 0.88 KDM4E (0.35) KDM4EATML3MBTL1HDAC4TSPO

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
EP-3767698-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-25 — — EP disclosed
US-20210119144-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-04-22 — — US disclosed
EP-3767698-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2021-01-20 — — EP disclosed
WO-2019176605-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2019-09-19 — — WO disclosed
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