SCHEMBL24739622

SCHEMBL24739622

O=C(Oc1ccncc1)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)Oc1ccncc1)C5=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
HIF1A Q16665 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.33
CYP2D6 P10635 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 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
SCHEMBL24739670 0.88 POLB (0.48) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739621 0.88 POLB (0.38) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739635 0.87 POLB (0.42) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739726 0.87 POLB (0.38) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739627 0.85 POLB (0.36) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739625 0.85 POLB (0.36) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739727 0.85 POLB (0.38) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739676 0.84 POLB (0.38) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739674 0.84 POLB (0.38) POLBALDH1A1TSHRSMN1; SMN2TP53
SCHEMBL24739699 0.83 POLB (0.41) POLBALDH1A1TSHRSMN1; SMN2TP53

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