SCHEMBL8896462

SCHEMBL8896462

Cc1ccc(S(=O)(=O)C(O)CN(CC(O)S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.50
TAS2R14 Q9NYV8 2/20 0.46
MAPT P10636 4/20 0.46
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 2/20 0.45
AGER Q15109 1/20 0.45
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CNR2 P34972 4/20 0.43
BACE1 P56817 2/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL28211577 0.79 TAS2R14 (0.65) GLATAS2R14MAPTNPSR1AGER
SCHEMBL28292240 0.77 GAA (0.46) MAPTHTTKMT2AKDM4EMEN1
SCHEMBL8778760 0.77 GAA (0.46) MAPTHTTKMT2AKDM4EMEN1
SCHEMBL9187490 0.76 GLA (0.53) GLATAS2R14MAPTHTTAGER
SCHEMBL30121315 0.76 GAA (0.54) MAPTKMT2AAGERLMNAMCOLN3
SCHEMBL6396982 0.75 GAA (0.45) MAPTHTTNPSR1KMT2AAGER
SCHEMBL2780461 0.75 GAA (0.45) MAPTHTTKMT2ALMNAKDM4E
SCHEMBL12215061 0.75 MAPT (0.48) GLATAS2R14MAPTHTTNPSR1
SCHEMBL4727639 0.75 CA2 (0.45) LMNACNR2GAA
SCHEMBL10692733 0.74 GLA (0.59) GLATAS2R14MAPTHTTAGER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1493566-A Preparation method of 1,4,7,10,13-penta azacyclopentadecane 江苏省原子医学研究所 2004-05-05 CN disclosed
US-5681543-A Polymer-bonded complexing agents and pharmaceutical agents containing them for MRI SHERING AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
US-5681544-A Polymer-bonded complexing agents, their complexes and conjugates, processes for their production and pharmaceutical agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1997-10-28 US disclosed
EP-0331616-B1 Polymer-bonded complexe builders, their complexes, process for their preparation and pharmaceutical agents containing the same SCHERING AG (DE) 1995-11-08 EP disclosed
EP-0305320-B1 MULTINUCLEIC SUBSTITUTED COMPLEXANTS, COMPLEXES AND COMPLEX SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL AGENTS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1992-09-23 EP disclosed
EP-0355097-A1 SUBSTITUTED CYCLIC COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURING SAME, AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1990-02-28 EP disclosed
EP-0305320-A2 Multinucleic substituted complexants, complexes and complex salts, process for their preparation and pharmaceutical agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1989-03-01 EP disclosed
WO-1988008422-A1 SUBSTITUTED CYCLIC COMPLEX-FORMING SUBSTANCES, COMPLEXES AND COMPLEX SALTS, PROCESS FOR MANUFACTURING SAME, AND PHARMACEUTICAL AGENTS WHICH CONTAIN THEM SCHERING AKTIENGESELLSCHAFT (DE) 1988-11-03 WO disclosed