SCHEMBL29024975

SCHEMBL29024975

O=C(CSc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1)OC1CCCCC1.O=C(O)C(Sc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1)C1CO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 18/20 0.37
MAPT P10636 5/20 0.37
HTT P42858 2/20 0.37
TSHR P16473 6/20 0.36
NPSR1 Q6W5P4 3/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 3/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 2/20 0.35
MAPK1 P28482 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 2/20 0.34
USP2 O75604 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
SCHEMBL1353009 0.87 ALDH1A1 (0.42) ALDH1A1MAPTHTTTSHRNPSR1
Acetic Acid SCHEMBL28782202 0.86 ALDH1A1 (0.42) ALDH1A1MAPTHTTTSHRNPSR1
SCHEMBL353199 0.83 CYP2C9 (0.31) HSD17B10CYP2C9CYP2C19
SCHEMBL28428769 0.79 ALDH1A1 (0.31) ALDH1A1MAPTHPGDL3MBTL1KDM4E
SCHEMBL1353008 0.77 MMP9 (0.35) ALDH1A1TSHRNPSR1
Acetic Acid SCHEMBL28782203 0.75 MMP9 (0.35) ALDH1A1TSHRNPSR1
SCHEMBL28388479 0.74 CYP19A1 (0.40) ALDH1A1MAPTHTTTSHRNPSR1
SCHEMBL29194290 0.71 BCL2L1 (0.41) ALDH1A1MAPTHTTTSHRNPSR1
SCHEMBL25343366 0.70 MMP9 (0.39) ALDH1A1NPSR1SMN1; SMN2KMT2ALMNA
SCHEMBL3341921 0.70 ALDH1A1 (0.43) ALDH1A1MAPTHTTTSHRNPSR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114981277-B Compound and optical film comprising same 株式会社LG化学 2024-06-11 CN disclosed
CN-113924299-B Compound, photosensitive fluorescent resin composition comprising the same, color conversion film manufactured therefrom, backlight unit, and display device 株式会社LG化学 2024-03-12 CN disclosed
CN-113993869-B Compound, photosensitive fluorescent resin composition comprising the same, color conversion film prepared using the same, backlight unit, and display device 株式会社LG化学 2023-12-22 CN disclosed
CN-114008055-B Compound and optical film comprising same 株式会社LG化学 2023-12-05 CN disclosed
CN-114450322-B Compound, binder resin, negative-type photosensitive resin composition, and display device including black bank formed using the negative-type photosensitive resin composition 株式会社LG化学 2023-06-27 CN disclosed