SCHEMBL4451410

SCHEMBL4451410

CCCCc1n[nH]cc1S(=O)(=O)Cl

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.33
HCAR2 Q8TDS4 2/20 0.31
HCAR3 P49019 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CA2 P00918 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TYMP P19971 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL20599591 0.78 CA2 (0.33) CA2
SCHEMBL27675062 0.73 HRH3 (0.37) HRH3HCAR2HCAR3ALDH1A1TYMP
SCHEMBL10438305 0.71 HRH3 (0.38) HRH3HCAR2HCAR3ALDH1A1TYMP
SCHEMBL7016897 0.71 HRH3 (0.38) HRH3HCAR2HCAR3ALDH1A1
SCHEMBL27797400 0.70 HRH3 (0.35) HRH3HCAR2HCAR3
SCHEMBL16324836 0.70
SCHEMBL11084609 0.69 HCAR2 (0.39) HRH3HCAR2HCAR3ALDH1A1HTT
SCHEMBL11832991 0.69 HRH3 (0.41) HRH3HCAR2HCAR3SMN1; SMN2ALDH1A1
SCHEMBL27854797 0.69 HRH3 (0.37) HRH3HCAR2HCAR3SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL27645958 0.69 HRH3 (0.34) HRH3HCAR2HCAR3

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
EP-1635822-A4 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS ELAN PHARM INC (US) 2009-06-24 EP disclosed
EP-1635871-A4 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS ELAN PHARM INC (US) 2007-07-18 EP disclosed
EP-1763361-A2 STEROID SPARING AGENTS AND THEIR USE Elan Pharmaceuticals, Inc. (US) 2007-03-21 EP disclosed
EP-1635871-A2 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS Elan Pharmaceuticals, Inc. (US) 2006-03-22 EP disclosed
EP-1635822-A2 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS Elan Pharmaceuticals, Inc. (US) 2006-03-22 EP disclosed
WO-2005097162-A2 STEROID SPARING AGENTS AND THEIR USE ELAN PHARMACEUTICALS, INC. (US) 2005-10-20 WO disclosed
WO-2005000246-A2 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS ELAN PHARMACEUTICALS, INC. (US) 2005-01-06 WO disclosed
WO-2005000244-A2 METHODS AND COMPOSITIONS FOR TREATING RHEUMATOID ARTHRITIS ELAN PHARMACEUTICALS, INC. (US) 2005-01-06 WO disclosed