SCHEMBL31605552

SCHEMBL31605552

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.38
▸ TSHR P16473 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ GALR3 O60755 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ S1PR4 O95977 1/20 0.34
▸ KAT7 O95251 2/20 0.33
▸ KAT6B Q8WYB5 2/20 0.33
▸ KAT6A Q92794 2/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ KAT5 Q92993 1/20 0.33

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
SCHEMBL21596821 1.00 MAPT (0.38) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL21596872 0.93 GALR3 (0.38) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL29652519 0.93 GALR3 (0.38) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL21596809 0.88 MAPT (0.36) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL29652454 0.88 MAPT (0.36) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL28906747 0.86 ALDH1A1 (0.32) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL29652522 0.86 ALDH1A1 (0.32) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL28507830 0.86 KAT7 (0.33) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL29652540 0.86 KAT7 (0.33) MAPTTSHRALDH1A1KMT2AHSD17B10
SCHEMBL29652513 0.82 CCNA2 (0.36) KDM4EKAT7KAT6BKAT6AKAT5

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-B Compounds of formula (I) CTXT私人有限公司 2025-05-30 — — CN disclosed
Send feedback