SCHEMBL24676249

SCHEMBL24676249

c1ccc(-c2cc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccc7c8ccccc8sc7c65)cc4)cc3)cc(-n3c4ccccc4c4ccccc43)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HDAC4 P56524 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
ALOX5 P09917 1/20 0.34
TP53 P04637 2/20 0.32
HSD17B10 Q99714 1/20 0.31
AKR1C4 P17516 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
AKR1C1 Q04828 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
LIMK1 P53667 2/20 0.30
KMT2A Q03164 1/20 0.30
IL1R1 P14778 1/20 0.30
GPR3 P46089 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 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
SCHEMBL24676197 1.00 KDM4E (0.40) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL17246456 0.96 L3MBTL1 (0.39) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL17246445 0.96 TNKS (0.36) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL24675449 0.95 KDM4E (0.38) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL24676125 0.95 KDM4E (0.38) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL10014566 0.95 TNKS (0.37) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL24923061 0.94 KDM4E (0.39) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL17246401 0.93 TNKS (0.36) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL10014563 0.93 L3MBTL1 (0.42) KDM4EATML3MBTL1HDAC4TNKS
SCHEMBL18868297 0.92 L3MBTL1 (0.40) KDM4EATML3MBTL1TNKSTNKS2

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
US-20220238815-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND, AND ELECTRONIC APPLIANCE IDEMITSU KOSAN CO.,LTD. (JP) 2022-07-28 US disclosed