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SCHEMBL21871174

SCHEMBL21871174

C1=CCCC(N(c2ccc(-c3ccc(N(C4=CC=CCC4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)=C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PTGER4 P35408 1/20 0.32
▸ TSPO P30536 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ KDR P35968 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
SCHEMBL18902831 0.98 KDM4E (0.38) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13863888 0.95 KDM4E (0.44) KDM4EATML3MBTL1KDR
SCHEMBL25553087 0.91 KDM4E (0.38) KDM4EATML3MBTL1
SCHEMBL19797458 0.90 KDM4E (0.34) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL22355065 0.89 KDM4E (0.31) KDM4EATML3MBTL1TSPO
SCHEMBL25827667 0.89 PTGDR2 (0.33) KDM4EATML3MBTL1
SCHEMBL21084441 0.88 L3MBTL1 (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL21140392 0.87 KDM4E (0.38) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13008947 0.87 KDM4E (0.38) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13710976 0.87 KDM4E (0.38) KDM4EATML3MBTL1

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
EP-3636726-A1 MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME Rohm And Haas Electronic Materials Korea Ltd. (KR) 2020-04-15 — — EP disclosed
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