SCHEMBL21959248

SCHEMBL21959248

C=C/C=C(\C=C)N(c1ccc(-c2ccc(F)cc2)cc1)c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ GRIA1 P42261 1/20 0.34
▸ CACNG8 Q8WXS5 1/20 0.34
▸ CACNG2 Q9Y698 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.32
▸ PER2 O15055 1/20 0.31
▸ CRY1 Q16526 1/20 0.31
▸ CRY2 Q49AN0 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30
▸ USP14 P54578 1/20 0.30
▸ REN P00797 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
SCHEMBL19988085 0.92 L3MBTL1 (0.41) KDM4EATML3MBTL1HDAC4ALDH1A1
SCHEMBL23486836 0.79 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL24445383 0.79 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL22332471 0.75 HDAC4 (0.32) HDAC4
SCHEMBL16084819 0.75 PTGDR2 (0.35) KDM4EATML3MBTL1
SCHEMBL20812891 0.74 L3MBTL1 (0.50) KDM4EATML3MBTL1GRIA1CACNG8
SCHEMBL20812957 0.74 L3MBTL1 (0.50) KDM4EATML3MBTL1GRIA1CACNG8
SCHEMBL21364996 0.74 L3MBTL1 (0.50) KDM4EATML3MBTL1GRIA1CACNG8
SCHEMBL16356559 0.74 KDM4E (0.50) KDM4EATML3MBTL1GRIA1CACNG8
SCHEMBL24135911 0.73 KDM4E (0.33) KDM4EATML3MBTL1HDAC4

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-3321341-B1 ORGANIC ELECTRONIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2020-04-29 — — EP disclosed
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