SCHEMBL8023841

SCHEMBL8023841

Cc1ccc(S(=O)(=O)NCCC(N)C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.55
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
ALDH1A1 P00352 9/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 2/20 0.51
LMNA P02545 1/20 0.51
USP2 O75604 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTT P42858 1/20 0.49
CA12 O43570 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49

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
Hydrochloric Acid SCHEMBL8567005 0.99 GBA1 (0.54) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL4432223 0.92 ALDH1A1 (0.56) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3449699 0.90 ALDH1A1 (0.55) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL3730989 0.90 ALDH1A1 (0.55) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL9497964 0.90 ALDH1A1 (0.55) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
Hydrochloric Acid SCHEMBL4438846 0.89 ALDH1A1 (0.54) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL10825521 0.87 ALDH1A1 (0.56) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL1768517 0.87 CA1 (0.63) SLC1A3SLC1A2SLC1A1ALDH1A1MEN1
SCHEMBL2234191 0.87 CA1 (0.63) SLC1A3SLC1A2SLC1A1ALDH1A1MEN1
SCHEMBL2235887 0.86 ALDH1A1 (0.54) GBA1SLC1A3SLC1A2SLC1A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973733-A1 BIS-SULFONOMIDES HYDROXAMIC ACIDS AS MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-01-26 EP disclosed
US-5859061-A MATRIX METALLOPROTEINASE INHIBITORS; TREATING DISEASES INVOLVING CONNECTIVE TISSUE DEGRADATION PHARMACIA & UPJOHN COMPANY (US) 1999-01-12 US disclosed
WO-1998031664-A1 BIS-SULFONOMIDES HYDROXAMIC ACIDS AS MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1998-07-23 WO disclosed