SCHEMBL24312480

SCHEMBL24312480

C=Cc1c(/C=C\C)n(-c2ccc(-c3ccccc3)cc2)c2c(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cccc12

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGER4 P35408 1/20 0.33
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 1/20 0.31
NPY5R Q15761 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

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
SCHEMBL23280788 0.89 KDM4E (0.38) KDM4EATML3MBTL1PTGER4AKR1C4
SCHEMBL24353130 0.89 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL19660122 0.86 KDM4E (0.38) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL21610874 0.84 KDM4E (0.43) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL24279085 0.84 KDM4E (0.30) KDM4EATML3MBTL1PTGER4
SCHEMBL15382706 0.83 KDM4E (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL23862306 0.83 KDM4E (0.32) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL23731992 0.83 KDM4E (0.38) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL27415120 0.82 KDM4E (0.38) KDM4EATML3MBTL1HDAC4AKR1C4
SCHEMBL20654999 0.82 KDM4E (0.37) KDM4EATML3MBTL1PTGER4TSPO

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-20220093878-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-03-24 US disclosed