SCHEMBL4711874

SCHEMBL4711874

CCCCCCCCCCCCNS(=O)(=O)c1ccc(CNCc2ccc(S(C)(=O)=O)cc2)s1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.53
HTT P42858 4/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.53
TSHR P16473 1/20 0.53
LMNA P02545 4/20 0.41
MAPK1 P28482 2/20 0.40
LOX P28300 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.39
NPY1R P25929 1/20 0.38
NPY5R Q15761 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CA2 P00918 1/20 0.38
RECQL P46063 1/20 0.38
ALDH1A1 P00352 3/20 0.37
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
S1PR2 O95136 1/20 0.36

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
SCHEMBL1856043 0.87 SMN1; SMN2 (0.56) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4019040 0.86 HTT (0.52) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL1852234 0.85 HTT (0.51) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4711870 0.83 HTT (0.52) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4025022 0.83 TSHR (0.49) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL1855640 0.81 SMN1; SMN2 (0.47) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4018514 0.80 KMT2A (0.53) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4715407 0.78 SMN1; SMN2 (0.69) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4717989 0.77 MEN1 (0.47) SMN1; SMN2HTTKMT2AMEN1TSHR
SCHEMBL4714650 0.77 MEN1 (0.47) SMN1; SMN2HTTKMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1986637-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS Laboratoires Serono SA (CH) 2008-11-05 EP claimed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 WO claimed
EP-1732534-A1 USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS Applied Research Systems ARS Holding N.V. (AN) 2006-12-20 EP claimed
WO-2005082347-A1 USE OF METHYLENE AMIDE DERIVATIVES IN CARDIOVASCULAR DISORDERS APLLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-09-09 WO claimed
EP-1470102-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-10-27 EP claimed
WO-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 WO claimed