SCHEMBL10730568

SCHEMBL10730568

NS(=O)(=O)c1ccc(NC=C(S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 3/20 0.51
▸ MAPT P10636 3/20 0.48
▸ CA1 P00915 8/20 0.44
▸ CA2 P00918 8/20 0.44
▸ CA9 Q16790 8/20 0.44
▸ CA4 P22748 6/20 0.44
▸ KDM4E B2RXH2 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CA12 O43570 3/20 0.40
▸ CA3 P07451 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ PLA2G7 Q13093 1/20 0.40
▸ CA13 Q8N1Q1 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.38
▸ ABCC9 O60706 1/20 0.37
▸ ABCC8 Q09428 1/20 0.37

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
SCHEMBL10726196 0.85 PKM (0.52) PKMMAPTCA1CA2CA9
SCHEMBL10731824 0.84 PKM (0.49) PKMMAPTKDM4EALDH1A1ABCC9
SCHEMBL10726719 0.82 PKM (0.52) PKMMAPTCA1CA2CA9
SCHEMBL10717754 0.82 ALDH1A1 (0.52) PKMMAPTCA1CA2CA9
SCHEMBL10716578 0.82 PKM (0.49) PKMMAPT
SCHEMBL10726333 0.81 PKM (0.48) PKMMAPTCA1CA2CA9
SCHEMBL10730985 0.81 MAPT (0.52) PKMMAPTGAAALDH1A1POLB
SCHEMBL10726331 0.80 LMNA (0.59) PKMMAPTKDM4EGAAALDH1A1
SCHEMBL10729039 0.80 PKM (0.56) PKMMAPTALDH1A1
SCHEMBL10731727 0.79 PKM (0.49) PKMMAPTCA2CA4ALDH1A1

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-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US claimed
US-4647569-A Antiarthritic pyridylaminoethene disulfonyl compounds and use MAY & BAKER LIMITED (GB) 1987-03-03 — — US disclosed
Send feedback