SCHEMBL16304344

SCHEMBL16304344

c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc7c(c6)c6ncccc6n7-c6ccccc6)c5)ccc43)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TOP1 P11387 7/20 0.38
▸ ALDH1A1 P00352 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ NPY5R Q15761 3/20 0.34
▸ PTGER4 P35408 2/20 0.34
▸ PDE4A P27815 1/20 0.32
▸ PDE4C Q08493 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ GRM5 P41594 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ PDE4B Q07343 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
SCHEMBL16304601 0.97 KDM4E (0.37) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL16304927 0.97 KDM4E (0.37) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL17349309 0.97 KDM4E (0.42) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL17349402 0.97 KDM4E (0.42) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL16304616 0.96 KDM4E (0.38) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL17349249 0.96 KDM4E (0.39) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL16304329 0.96 KDM4E (0.39) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL17349339 0.96 KDM4E (0.39) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL16304340 0.94 TOP1 (0.40) KDM4EATML3MBTL1TOP1ALDH1A1
SCHEMBL16304377 0.94 TOP1 (0.39) KDM4EATML3MBTL1TOP1ALDH1A1

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
US-9685614-B2 Material for organic electroluminescent element, and element using same IDEMITSU KOSAN CO., LTD. (JP) 2017-06-20 — — US disclosed
US-9685614-B2 Material for organic electroluminescent element, and element using same IDEMITSU KOSAN CO., LTD. (JP) 2017-06-20 — — US disclosed
US-20140367667-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-18 — — US disclosed
US-20140367667-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2014-12-18 — — US disclosed
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