SCHEMBL10717698

SCHEMBL10717698

O=S(=O)(C(=CNc1ccc(Cl)cc1)S(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.72
▸ MEN1 O00255 5/20 0.63
▸ KMT2A Q03164 5/20 0.63
▸ CA2 P00918 4/20 0.57
▸ CA1 P00915 3/20 0.57
▸ CA4 P22748 3/20 0.57
▸ CA9 Q16790 3/20 0.57
▸ PKM P14618 3/20 0.50
▸ ALDH1A1 P00352 5/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 1/20 0.43

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
SCHEMBL10716650 0.88 MAPT (0.78) MAPTMEN1KMT2ACA2CA1
SCHEMBL10716463 0.84 MAPT (0.64) MAPTMEN1KMT2ACA2CA1
SCHEMBL10717891 0.84 MAPT (1.00) MAPTMEN1KMT2ACA2CA1
SCHEMBL10725846 0.81 ALDH1A1 (0.54) MAPTMEN1KMT2ACA2CA1
SCHEMBL10719158 0.80 MAPT (0.71) MAPTMEN1KMT2APKMALDH1A1
SCHEMBL10726650 0.77 MEN1 (0.53) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL10730945 0.75 PKM (0.58) MAPTMEN1KMT2ACA2CA1
SCHEMBL10718981 0.74 ALDH1A1 (0.43) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL10716561 0.74 CASP3 (0.52) MAPTMEN1KMT2ACA2CA1
SCHEMBL11783528 0.73 MAPT (0.43) MAPTMEN1KMT2ACA2CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4659727-A ANTIARTHRITIC AGENTS MAY & BAKER LIMITED (GB) 1987-04-21 — — US disclosed
EP-0174832-A2 Ethene derivatives MAY & BAKER LIMITED (GB) 1986-03-19 — — EP disclosed
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