SCHEMBL24739726

SCHEMBL24739726

CCCOC(=O)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)OCCC)C5=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
TP53 P04637 4/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HIF1A Q16665 1/20 0.36
MDM2 Q00987 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
CYP2D6 P10635 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 4/20 0.32
GAA P10253 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
HSD11B1 P28845 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
USP2 O75604 2/20 0.31

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
SCHEMBL24739727 0.93 POLB (0.38) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739635 0.90 POLB (0.42) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739670 0.90 POLB (0.48) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739979 0.88 POLB (0.36) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739674 0.88 POLB (0.38) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739621 0.87 POLB (0.38) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739627 0.87 POLB (0.36) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739625 0.87 POLB (0.36) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739622 0.87 POLB (0.36) POLBTP53ALDH1A1SMN1; SMN2CYP3A4
SCHEMBL24739782 0.86 POLB (0.44) POLBTP53ALDH1A1MDM2KMT2A

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