SCHEMBL27409783

SCHEMBL27409783

C1=C(c2cccc(-c3cccc(-c4ccccc4)c3)c2)C=C(c2nc(-c3ccc(-c4cccc(-c5cccc(-c6cccc(-c7ccccc7)c6)c5)c4)cc3)cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)CC1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ GLA P06280 1/20 0.32
▸ PDE10A Q9Y233 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
SCHEMBL18562421 0.94 KDM4E (0.33) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL24735775 0.88 KDM4E (0.33) KDM4EATML3MBTL1PDE10A
SCHEMBL23047521 0.88 KDM4E (0.35) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL24735464 0.88 KDM4E (0.30) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL25010813 0.83 L3MBTL1 (0.39) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL26480271 0.83 L3MBTL1 (0.39) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL24735772 0.83 — —
SCHEMBL23759842 0.81 MEN1 (0.47) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL24735460 0.81 MEN1 (0.47) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL15458409 0.81 MEN1 (0.47) KDM4EATML3MBTL1MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024117109-A1 COMPOSITION FOR FORMING LIGHT EMITTING LAYER OF ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR PRODUCING SAME, AND DISPLAY DEVICE 三菱ケミカル株式会社 2024-06-06 — — WO disclosed
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