SCHEMBL28507830

SCHEMBL28507830

CCc1ccc(OC)c(S(=O)(=O)N(OCc2ccc(OC)cc2OC)c2noc3c(C4CC4)cccc23)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT7 O95251 5/20 0.33
▸ KAT6A Q92794 5/20 0.33
▸ KAT6B Q8WYB5 4/20 0.33
▸ KAT5 Q92993 3/20 0.33
▸ KAT8 Q9H7Z6 3/20 0.33
▸ BRD4 O60885 2/20 0.33
▸ BRD2 P25440 2/20 0.33
▸ BRD3 Q15059 2/20 0.33
▸ MAPT P10636 3/20 0.33
▸ TSHR P16473 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ ALPL P05186 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
SCHEMBL29652540 1.00 KAT7 (0.33) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL29652454 0.88 MAPT (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL21596809 0.88 MAPT (0.36) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL28906747 0.86 ALDH1A1 (0.32) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL21596821 0.86 MAPT (0.38) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL31605552 0.86 MAPT (0.38) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL29652522 0.86 ALDH1A1 (0.32) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL21596872 0.84 GALR3 (0.38) MAPTTSHRALDH1A1KMT2AMEN1
SCHEMBL29652519 0.84 GALR3 (0.38) MAPTTSHRALDH1A1KMT2AMEN1
SCHEMBL28512950 0.83 CCNA2 (0.36) KAT7KAT6AKAT6BKAT5KAT8

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
CN-112334466-A Compound (I) CTXT私人有限公司 2021-02-05 — — CN disclosed
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