SCHEMBL3520533

SCHEMBL3520533

N[N]S(=O)(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA12 O43570 1/20 0.55
CA3 P07451 1/20 0.55
CA4 P22748 1/20 0.55
CA6 P23280 1/20 0.55
CA5A P35218 1/20 0.55
CA7 P43166 1/20 0.55
PLA2G7 Q13093 1/20 0.55
CA9 Q16790 1/20 0.55
CA13 Q8N1Q1 1/20 0.55
CA14 Q9ULX7 1/20 0.55
CA5B Q9Y2D0 1/20 0.55
HTR6 P50406 2/20 0.52
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL544207 0.80 HTR6 (0.55) CA1CA2CA12CA3CA4
SCHEMBL6172350 0.78 HTR6 (0.52) CA1CA2CA12CA3CA4
SCHEMBL4628244 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4
SCHEMBL2134610 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4
SCHEMBL2687422 0.76 ALDH1A1 (0.52) CA1CA2CA12CA3CA4
SCHEMBL7292002 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4
SCHEMBL6717470 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4
SCHEMBL17808674 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4
SCHEMBL9398028 0.76 TSHR (0.52) CA1CA2CA12CA3CA4
SCHEMBL28574997 0.76 HTR6 (0.50) CA1CA2CA12CA3CA4

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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0793656-B1 NOVEL BENZYL PYRIMIDINES BASILEA PHARMACEUTICA AG (CH) 2003-03-26 EP claimed
US-5300676-A Herbicidal fluorine-substituted alpha-(5-aryloxynaphthalen-1-yl-oxy)-propionic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1994-04-05 US claimed
EP-0553630-A1 Pyridyloxy-naphthalines as herbicides BAYER AG (DE) 1993-08-04 EP claimed
EP-0537538-A1 Derivatives of fluorinated phenoxyphenoxycarboxylic acid as herbicides BAYER AG (DE) 1993-04-21 EP claimed
EP-0534239-A2 Derivatives of alpha-(5-dichlorphenoxy-naphthalen-1-yl-oxy)propionic acid as herbicides BAYER AG (DE) 1993-03-31 EP claimed
EP-0369212-B1 DERIVATIVES OF (HETERO)ARYLOXYNAPHTHALENE, PROCESS, AND (HETERO)ARYLOXYNAPHTHYL AMINES, AND THEIR USE AS HERBICIDES BAYER AG (DE) 1993-02-17 EP claimed
US-5166402-A Herbicidal α-(5-aryloxy-naphthalen-1-yl-oxy)-propionic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1992-11-24 US claimed
WO-1992018467-A1 CYANOPHENOXYNAPHTHYL OXYCARBOXYLIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1992-10-29 WO claimed
EP-0308755-B1 DERIVATIVES OF 7-(HETERO)ARYLOXY-NAPHTHALEN-2-YLOXY)ALCANOIC ACID BAYER AG (DE) 1992-10-28 EP claimed
EP-0508263-A2 Derivatives of alpha-(5 aryloxy-1 naphthyloxy)-carboxylic acid BAYER AG (DE) 1992-10-14 EP claimed
EP-0453846-A2 Aryloxycarbonyl compounds BAYER AG (DE) 1991-10-30 EP claimed
EP-0309864-B1 ALPHA-(5-ARYLOXY-NAPHTHALEN-1-YL-OXY)-PROPIONIC-ACID DERIVATIVES BAYER AG (DE) 1991-05-22 EP claimed
EP-0384230-A1 Substituted phenoxyphenyl propionic acid derivatives BAYER AG (DE) 1990-08-29 EP claimed
EP-0347679-A1 1,7-Dioxynaphthalene derivatives BAYER AG (DE) 1989-12-27 EP claimed
EP-0338306-A2 Halogen-substituted phenoxybenzyl compounds BAYER AG (DE) 1989-10-25 EP claimed
EP-0313908-A2 Halogen-substituted phenoxyphenylpropionic acid derivatives BAYER AG (DE) 1989-05-03 EP claimed
EP-0309864-A1 Alpha-(5-aryloxy-naphthalen-1-yl-oxy)-propionic-acid derivatives BAYER AG (DE) 1989-04-05 EP claimed
EP-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 EP claimed
EP-0173320-A1 Substituted carbonylphenylsulfonyl guanidines BAYER AG (DE) 1986-03-05 EP claimed
US-4176188-A SUBSTITUTED OXEPANE ORTHO PHARMACEUTICAL CORP. (US) 1979-11-27 US claimed