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Sugi Predict / Compounds / SCHEMBL24908970

SCHEMBL24908970

SCHEMBL24908970

CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6c(Oc7ccc(C(C)(C)C)cc7)cc7c8c(cc(Oc9ccc(C(C)(C)C)cc9)c(c2c45)c86)C(=O)N(C(Cc2ccccc2)C(=O)OC(C(F)(F)F)C(F)(F)F)C7=O)C(=O)N(C(Cc2ccccc2)C(=O)OC(C(F)(F)F)C(F)(F)F)C3=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 3/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ GAA P10253 2/20 0.40
▸ MCL1 Q07820 1/20 0.40
▸ DNMT1 P26358 3/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ AADAT Q8N5Z0 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ TSHR P16473 1/20 0.36

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
SCHEMBL24909257 0.88 DNMT1 (0.36) ALDH1A1DNMT1NPSR1
SCHEMBL24909185 0.88 KMT2A (0.48) KMT2APOLBALDH1A1GAAMCL1
SCHEMBL24705072 0.88 ALDH1A1 (0.53) KMT2APOLBALDH1A1GAAMCL1
SCHEMBL24739994 0.88 KMT2A (0.41) KMT2APOLBALDH1A1GAAHSD11B1
SCHEMBL24739718 0.84 POLB (0.40) KMT2APOLBALDH1A1GAAHSD11B1
SCHEMBL24908693 0.83 MAPT (0.43) KMT2APOLBALDH1A1GAAMCL1
SCHEMBL24908987 0.82 MAPT (0.55) KMT2APOLBALDH1A1DNMT1MEN1
SCHEMBL24704915 0.82 KMT2A (0.41) KMT2APOLBALDH1A1GAAMCL1
SCHEMBL24909333 0.82 DNMT1 (0.31) ALDH1A1DNMT1NPSR1
SCHEMBL24909194 0.82 MGLL (0.37) KMT2APOLBALDH1A1GAADNMT1

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-20230023648-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM PREPARED USING SAME, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD (KR) 2023-01-26 — — US disclosed