SCHEMBL24739635

SCHEMBL24739635

O=C(OCc1ccccc1)C(Cc1ccc(O)cc1)N1C(=O)c2cc(Oc3cccc(OCC4CO4)c3)c3c4c(Oc5cccc(OCC6CO6)c5)cc5c6c(cc(Oc7cccc(OCC8CO8)c7)c(c7c(Oc8cccc(OCC9CO9)c8)cc(c2c37)C1=O)c64)C(=O)N(C(Cc1ccc(O)cc1)C(=O)OCc1ccccc1)C5=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
GAA P10253 2/20 0.36
HSD11B1 P28845 1/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP2D6 P10635 1/20 0.35
AADAT Q8N5Z0 1/20 0.34
MGLL Q99685 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL24739670 0.92 POLB (0.48) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739726 0.90 POLB (0.38) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739698 0.89 POLB (0.40) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24740710 0.89 MEN1 (0.41) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739621 0.88 POLB (0.38) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739727 0.88 POLB (0.38) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739699 0.88 POLB (0.41) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739625 0.87 POLB (0.36) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739622 0.87 POLB (0.36) POLBALDH1A1TP53CYP3A4TSHR
SCHEMBL24739627 0.87 POLB (0.36) POLBALDH1A1TP53CYP3A4TSHR

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-20220390841-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD. (KR) 2022-12-08 US disclosed