SCHEMBL7672822

SCHEMBL7672822

O=S(=O)(Nc1ccccc1N1CCCN(c2ccc(Cl)cc2)CC1)c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCOLN3 Q8TDD5 5/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
PKM P14618 2/20 0.62
MCOLN2 Q8IZK6 1/20 0.53
MCOLN1 Q9GZU1 1/20 0.53
ALDH1A1 P00352 5/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 3/20 0.50
GAA P10253 3/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 1/20 0.50
PGAM1 P18669 2/20 0.49
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
APAF1 O14727 1/20 0.48
MAPK1 P28482 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
SCHEMBL21244029 0.90 ALDH1A1 (0.54) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL29978305 0.90 MCOLN3 (0.76) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL23043775 0.90 MCOLN3 (0.76) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL21244028 0.83 MCOLN3 (0.60) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL29978358 0.78 L3MBTL1 (0.79) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL23043676 0.78 L3MBTL1 (0.79) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL21244032 0.77 MCOLN3 (0.58) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL21244033 0.77 MCOLN3 (0.58) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL23044095 0.76 MCOLN3 (0.76) MCOLN3L3MBTL1PKMMCOLN2MCOLN1
SCHEMBL23043601 0.76 MCOLN3 (0.76) MCOLN3L3MBTL1PKMMCOLN2MCOLN1

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-6403607-B1 ANTIULCER Hidaka, Hiroyoshi (JP) 2002-06-11 US disclosed
EP-1072587-A1 SULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Hidaka, Hiroyoshi (JP) 2001-01-31 EP disclosed