SCHEMBL24740211

SCHEMBL24740211

C=C(C)C(=O)OCCc1ccc(Oc2cc3c4c(cc(Oc5ccc(CCOC(=O)C(=C)C)cc5)c5c6c(Oc7ccc(CCOC(=O)C(=C)C)cc7)cc7c8c(cc(Oc9ccc(CCOC(=O)C(=C)C)cc9)c(c2c45)c86)C(=O)N(C(CC(C)C)C(=O)Nc2cccc(C)c2)C7=O)C(=O)N(C(CC(C)C)C(=O)Nc2cccc(C)c2)C3=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 2/20 0.37
GCK P35557 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.32

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
SCHEMBL24740757 0.89 GCK (0.38) USP2TSHRLMNAGCKALDH1A1
SCHEMBL24740210 0.88 USP2 (0.37) USP2TSHRGCKMAPTMEN1
SCHEMBL24739941 0.86 GCK (0.37) USP2TSHRLMNAGCKALDH1A1
SCHEMBL24739798 0.85 MCL1 (0.38) GCKALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL24739746 0.84 GAA (0.46) TSHRGCKALDH1A1MAPTKMT2A
SCHEMBL24739817 0.84 GAA (0.34) USP2TSHRGCKALDH1A1MAPT
SCHEMBL24739928 0.84 MAPT (0.32) USP2LMNAALDH1A1HSD17B10MAPT
SCHEMBL24740760 0.83 GCK (0.33) GCKALDH1A1MAPTTP53GAA
SCHEMBL24739816 0.83 THRB (0.33) GCKALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL24739654 0.82 MAPT (0.37) USP2LMNAGCKALDH1A1HSD17B10

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