SCHEMBL25927059

SCHEMBL25927059

OB(O)c1cccc(-n2c3ccccc3c3cc4c5c6ccccc6ccc5n(-c5ccccc5)c4cc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
MGLL Q99685 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
PTGES O14684 1/20 0.31
VCP P55072 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
PRSS1 P07477 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
SCHEMBL28705444 0.89 CA1 (0.39) KDM4EATML3MBTL1CA1CA2
SCHEMBL29403079 0.89 CA1 (0.39) KDM4EATML3MBTL1CA1CA2
SCHEMBL22868623 0.88 KDM4E (0.50) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL19176496 0.88 KDM4E (0.53) KDM4EATML3MBTL1MGLLALDH1A1
SCHEMBL17989767 0.87 KDM4E (0.55) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL29849166 0.85 CA1 (0.44) KDM4EATML3MBTL1CA1CA2
SCHEMBL13189826 0.85 CA1 (0.44) KDM4EATML3MBTL1CA1CA2
SCHEMBL18019437 0.85 CA1 (0.42) KDM4EATML3MBTL1CA1CA2
SCHEMBL17990338 0.84 L3MBTL1 (0.49) KDM4EATML3MBTL1JAK2JAK3
SCHEMBL22186213 0.83 L3MBTL1 (0.45) KDM4EATML3MBTL1JAK2JAK3

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-11706984-B2 Plurality of host materials and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. 2023-07-18 US disclosed