SCHEMBL24907863

SCHEMBL24907863

C1=CC(c2nc(-c3ccc(-c4ccc5ccc6ccccc6c5c4)cc3)nc(-c3cccc4oc5cc(-c6ccccc6)ccc5c34)n2)=CCC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL24886603 0.96 KDM4E (0.32) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL25854957 0.94 TDP1 (0.30) TDP1L3MBTL1
SCHEMBL24315437 0.93 KDM4E (0.34) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL26341695 0.93 KDM4E (0.33) KDM4EALDH1A1TP53SMN1; SMN2HSD17B10
SCHEMBL24886614 0.92 HSD17B1 (0.31)
SCHEMBL24972110 0.92 ALDH1A1 (0.32) KDM4EALDH1A1TP53MAPTSMN1; SMN2
SCHEMBL26037500 0.91 KDM4E (0.31) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL24972022 0.91 PLA2G2A (0.32)
SCHEMBL24314783 0.91 KDM4E (0.31) KDM4EALDH1A1TP53SMN1; SMN2HSD17B10
SCHEMBL25640483 0.90 CYP11B1 (0.31) KDM4EALDH1A1TP53MAPTHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243102-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 EP disclosed
WO-2023003436-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed