SCHEMBL25501901

SCHEMBL25501901

c1ccc2c(-c3cccc4oc5ccccc5c34)cc(-c3nc(-c4ccc5ccc6ccccc6c5c4)nc(-c4ccc5ccc6oc7ccccc7c6c5c4)n3)cc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.35
HSD17B10 Q99714 8/20 0.35
HPGD P15428 6/20 0.35
TSHR P16473 4/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
MAPK1 P28482 3/20 0.35
CASP1 P29466 2/20 0.35
HIF1A Q16665 2/20 0.35
MAPT P10636 7/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KDM4E B2RXH2 6/20 0.35
ALOX15 P16050 1/20 0.35
CASP7 P55210 1/20 0.35
TDP1 Q9NUW8 3/20 0.35
ATM Q13315 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
PIM1 P11309 1/20 0.34

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
SCHEMBL25502066 0.98 L3MBTL1 (0.37) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25501992 0.95 ALDH1A1 (0.35) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25502063 0.95 ALDH1A1 (0.38) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25502068 0.94 ALDH1A1 (0.36) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25501994 0.94 ENPP3 (0.36) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25501897 0.94 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25501606 0.94 L3MBTL1 (0.38) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL23822642 0.94 ALDH1A1 (0.39) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25503739 0.94 L3MBTL1 (0.41) ALDH1A1HSD17B10HPGDTSHRL3MBTL1
SCHEMBL25501990 0.93 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDTSHRL3MBTL1

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
WO-2023096318-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-06-01 WO disclosed