SCHEMBL24315437

SCHEMBL24315437

C1=CC(c2nc(-c3ccccc3)nc(-c3cccc4oc5ccc(-c6ccc7ccc8ccccc8c7c6)cc5c34)n2)=CCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
TSHR P16473 3/20 0.34
HSD17B10 Q99714 3/20 0.34
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
MAPK1 P28482 2/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PLA2G2A P14555 2/20 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
SCHEMBL25854957 0.94 TDP1 (0.30) TDP1L3MBTL1
SCHEMBL26899558 0.93 PLA2G2A (0.34) L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL24990912 0.93 KDM4E (0.34) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL24907863 0.93 KDM4E (0.32) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL26321825 0.92 PLA2G2A (0.34) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL19802902 0.92 PLA2G2A (0.34) L3MBTL1PLA2G2APLA2G4APLA2G10
SCHEMBL25833028 0.92 KDM4E (0.33) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL24972686 0.91 SIRT2 (0.32) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL24314947 0.91 CYP11B1 (0.31) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL24972690 0.91 PLA2G2A (0.33) PLA2G2APLA2G4APLA2G10

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-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed