SCHEMBL9162804

SCHEMBL9162804

Cc1ccc(S(=O)(=O)OCCCCCCCCCCCN2CCCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.56
MBTD1 Q05BQ5 1/20 0.56
HRH3 Q9Y5N1 9/20 0.54
KCNH2 Q12809 2/20 0.54
HRH1 P35367 1/20 0.52
MAPK14 Q16539 2/20 0.49
KDM4E B2RXH2 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL2490457 0.94 L3MBTL1 (0.58) L3MBTL1MBTD1HRH3KCNH2HRH1
Hydrochloric Acid SCHEMBL9449150 0.93 L3MBTL1 (0.57) L3MBTL1MBTD1HRH3KCNH2HRH1
SCHEMBL2491906 0.88 MBTD1 (0.54) L3MBTL1MBTD1HRH3KCNH2HRH1
SCHEMBL19733679 0.87 MBTD1 (0.55) L3MBTL1MBTD1HRH3KCNH2HRH1
SCHEMBL8484861 0.83 ALDH1A1 (0.48)
SCHEMBL4812770 0.83 ALDH1A1 (0.48)
SCHEMBL4815560 0.83 ALDH1A1 (0.48)
SCHEMBL8483813 0.83 ALDH1A1 (0.48)
SCHEMBL4951882 0.83 ALDH1A1 (0.48)
SCHEMBL11050599 0.83 ALDH1A1 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5140128-A None JP disclosed
US-5416210-A Polymers or monomers protecting and controlling microorganisms from fungi, bacteria, algae, viruses and yeasts on a variety of substrates ROHM AND HAAS COMPANY (US) 1995-05-16 US disclosed
JP-H05140128-A ANTIMICROBIAL POLYMERIC QUATERNARY AMMONIUM SALT ROHM & HAAS CO 1993-06-08 JP disclosed
US-5149524-A Polymerizing N-heterocyclic sulfonate ROHM AND HAAS COMPANY (US) 1992-09-22 US disclosed
EP-0493970-A1 Antimicrobial polymeric quaternary ammonium salts ROHM AND HAAS COMPANY (US) 1992-07-08 EP disclosed