SCHEMBL30025440

SCHEMBL30025440

CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(Br)ccc43)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 2/20 0.37
▸ PDK2 Q15119 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ RAD52 P43351 1/20 0.33
▸ CAMK2D Q13557 1/20 0.33
▸ GSK3B P49841 6/20 0.32
▸ CCNB2 O95067 3/20 0.32
▸ CDK1 P06493 3/20 0.32
▸ CCNB1 P14635 3/20 0.32
▸ CCNB3 Q8WWL7 3/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ DNMT1 P26358 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ ACHE P22303 1/20 0.31

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
SCHEMBL14822288 1.00 TSPO (0.37) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL18927683 0.96 TSPO (0.35) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL15790350 0.93 TSPO (0.37) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL20262120 0.93 PDK2 (0.35) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL10307239 0.91 KDM4E (0.40) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL17425767 0.91 KDM4E (0.40) PDK2KDM4EATML3MBTL1MEN1
SCHEMBL13566823 0.89 KDM4E (0.43) PDK2KDM4EATML3MBTL1PGR
SCHEMBL30655846 0.89 KDM4E (0.43) PDK2KDM4EATML3MBTL1PGR
SCHEMBL17197500 0.89 PGR (0.38) PDK2MEN1KMT2AGSK3BCCNB2
SCHEMBL15790445 0.89 CAMK2D (0.34) TSPOPDK2KDM4EATML3MBTL1

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
CN-115490630-B Organic compound, organic electroluminescent device and electronic apparatus 陕西莱特光电材料股份有限公司 2024-11-05 — — CN disclosed
CN-115490630-A Organic compound, organic electroluminescent device, and electronic device 陕西莱特迈思光电材料有限公司 2022-12-20 — — CN disclosed
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