SCHEMBL25676263

SCHEMBL25676263

C1=CC(c2nc(-c3ccccc3)nc(-c3cc4c(oc5cccc(-c6ccccc6)c54)c4ccccc34)n2)CC=C1c1cccc2ccccc12

nearest known ligand 0.32

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
SCHEMBL25682213 0.93 KDM4E (0.32) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24521261 0.89
SCHEMBL24314422 0.86 ALDH1A1 (0.33) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24521009 0.85 MAPK1 (0.32) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24973151 0.85 ALDH1A1 (0.33) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24972042 0.85 KDM4E (0.33) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24971396 0.84 KDM4E (0.32) KDM4EALDH1A1TP53MAPTHPGD
SCHEMBL24521146 0.84
SCHEMBL24521360 0.84 MAPT (0.31) KDM4EALDH1A1MAPTTSHRMAPK1
SCHEMBL25676414 0.83 MAPT (0.32) KDM4EALDH1A1MAPTTSHRMAPK1

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-4201931-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LT Materials Co., Ltd. (KR) 2023-06-28 EP disclosed