SCHEMBL11540311

SCHEMBL11540311

Nc1cc(S(N)(=O)=O)ccc1O.c1ccc(Nc2ccc3ccccc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.58
CA2 P00918 7/20 0.56
CA1 P00915 5/20 0.56
CA9 Q16790 5/20 0.56
CA12 O43570 3/20 0.56
LMNA P02545 1/20 0.56
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP3A4 P08684 1/20 0.54
HPGD P15428 1/20 0.54
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NSD2 O96028 1/20 0.51
DUSP3 P51452 1/20 0.51
PTPN5 P54829 1/20 0.51
CASP7 P55210 1/20 0.51
CASP6 P55212 1/20 0.51
PTPN11 Q06124 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.47
CCNA2 P20248 1/20 0.46

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
SCHEMBL11690810 0.88 SNCA (0.53) SNCACA2CA1CA9CA12
SCHEMBL618161 0.86 SNCA (0.71) SNCACA2CA1CA9CA12
SCHEMBL28746782 0.83 LMNA (0.70) SNCACA2CA1CA9CA12
Betanaphthol SCHEMBL10765809 0.81 CA2 (0.67) CA2CA1CA9CA12LMNA
SCHEMBL564969 0.77 CYP3A4 (0.59) LMNAALDH1A1HSD17B10CYP3A4HPGD
SCHEMBL193716 0.75 LMNA (1.00) CA2CA1CA9CA12LMNA
SCHEMBL3317877 0.75 CA2 (1.00) CA2CA1CA9CA12ALDH1A1
SCHEMBL11674227 0.74 SNCA (0.81) SNCACA2CA1LMNAALDH1A1
SCHEMBL29843770 0.74 SNCA (1.00) SNCACA2LMNAALDH1A1HSD17B10
SCHEMBL29668447 0.74 SNCA (1.00) SNCACA2LMNAALDH1A1HSD17B10

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-4155903-A Asymmetrical 1:2 cobalt complexes of certain substituted phenylazonaphthalenes SANDOZ LTD. (CH) 1979-05-22 US disclosed