SCHEMBL23472967

SCHEMBL23472967

CC1CC=Cc2c1n(-c1ccc(/C=C/c3ccc(/C=C/c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc1)c1ccccc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HDAC4 P56524 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ KLK7 P49862 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL18568854 0.89 KDM4E (0.40) KDM4EATML3MBTL1HDAC4
SCHEMBL25879209 0.85 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL19774408 0.85 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL19003203 0.85 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL25956652 0.84 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL22415195 0.84 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL21388324 0.83 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL19648980 0.83 KDM4E (0.39) KDM4EATML3MBTL1HDAC4
SCHEMBL20460059 0.81 DRD1 (0.33) KDM4EATML3MBTL1HDAC4MEN1
SCHEMBL20707565 0.81 KDM4E (0.40) 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-3831819-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-06-09 — — EP disclosed
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