SCHEMBL24945339

SCHEMBL24945339

c1ccc(-c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5cccc6cccc(-c7ccccc7)c56)cc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ATM Q13315 2/20 0.43
PDE6D O43924 1/20 0.40
CYP3A4 P08684 2/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 2/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL24945449 1.00 ALDH1A1 (0.43) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24945450 0.98 ALDH1A1 (0.47) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24945436 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL22837463 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL25972683 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24945492 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24153911 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24154792 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL22837542 0.98 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10
SCHEMBL24944483 0.96 ALDH1A1 (0.48) ALDH1A1L3MBTL1TSHRMAPK1HSD17B10

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-20230013038-A1 LIGHT EMITTING DEVICE AND AMINE COMPOUND FOR LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-01-19 US disclosed