SCHEMBL11457925

SCHEMBL11457925

CC(=O)/C(=C\Nc1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 4/20 0.57
▸ CA1 P00915 3/20 0.57
▸ CA4 P22748 3/20 0.57
▸ CA9 Q16790 3/20 0.57
▸ MAPT P10636 1/20 0.55
▸ PKM P14618 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ HTT P42858 3/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HPGD P15428 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ BCAT1 P54687 1/20 0.40

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
SCHEMBL11457926 1.00 CA2 (0.57) CA2CA1CA4CA9MAPT
SCHEMBL10716650 0.78 MAPT (0.78) CA2CA1CA4CA9MAPT
SCHEMBL10716672 0.76 ALDH1A1 (0.50) CA2CA1CA4CA9MAPT
SCHEMBL11564392 0.75 AKR1C3 (0.48) CA2CA1CA4PKMALDH1A1
SCHEMBL11564387 0.75 AKR1C3 (0.48) CA2CA1CA4PKMALDH1A1
SCHEMBL4516541 0.73 NAPRT (0.54) MAPTALDH1A1NPC1KMT2AHTT
SCHEMBL14135580 0.72 RECQL (0.45) CA2CA1CA4CA9MAPT
SCHEMBL13856976 0.72 RECQL (0.45) CA2CA1CA4CA9MAPT
SCHEMBL10717891 0.71 MAPT (1.00) CA2CA1CA4CA9MAPT
SCHEMBL18871131 0.70 ALDH1A1 (0.46) MAPTPKMALDH1A1NPC1KMT2A

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-4191576-A SULFONYL-SUBSTITUTED PYRROLIDINE, OXAZOLIDINE OR THIAZOLIDINE FUJI PHOTO FILM CO., LTD. (JP) 1980-03-04 — — US disclosed
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