SCHEMBL25008910

SCHEMBL25008910

c1ccc(-c2nc(-c3ccc4cc(-c5ccccc5-c5ccccc5)ccc4c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
KDM4E B2RXH2 5/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
HSD17B10 Q99714 4/20 0.38
TP53 P04637 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP1A2 P05177 2/20 0.38
ALOX5 P09917 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
MAPT P10636 7/20 0.37
HPGD P15428 3/20 0.37
TSHR P16473 2/20 0.37
ATM Q13315 2/20 0.37
MAPK1 P28482 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL24314670 0.96 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL23821034 0.95 ALDH1A1 (0.38) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL24889531 0.94 ALDH1A1 (0.39) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL24890295 0.94 PGR (0.38) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL25008920 0.93 PGR (0.39) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL15501670 0.93 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL23920390 0.93 PGR (0.39) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL24372505 0.93 PGR (0.39) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL23822652 0.93 ALDH1A1 (0.40) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL23027613 0.92 BACE1 (0.37) ALDH1A1KDM4EMEN1KMT2AHSD17B10

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-4289836-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-12-13 EP disclosed
WO-2023014004-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-02-09 WO disclosed