SCHEMBL8764385

SCHEMBL8764385

O=S(=O)(CS(=O)(=O)C(F)(F)F)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.51
MMP9 P14780 10/20 0.51
MMP14 P50281 1/20 0.51
MMP3 P08254 1/20 0.48
MMP13 P45452 1/20 0.48
TP53 P04637 1/20 0.45
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
MMP1 P03956 3/20 0.44
FFAR4 Q5NUL3 1/20 0.43
KIF11 P52732 1/20 0.41
PTGS2 P35354 2/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40

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
Tetramethylammonium Ion SCHEMBL8854311 0.94 MMP2 (0.47) MMP2MMP9MMP14MMP3MMP13
SCHEMBL13239545 0.83 MMP13 (0.51) MMP2MMP9MMP13MMP1
SCHEMBL14572900 0.80 MMP2 (0.55) MMP2MMP9MMP14MMP3MMP13
SCHEMBL9172442 0.80 MMP2 (0.49) MMP2MMP9MMP14MMP3MMP13
SCHEMBL2377118 0.79 MMP2 (0.54) MMP2MMP9MMP14MMP3MMP13
SCHEMBL8763331 0.78 ALDH1A1 (0.43) MMP2MMP9MMP14MMP13MMP1
SCHEMBL21649301 0.77 TP53 (0.56) MMP2MMP9MMP14MMP3MMP13
SCHEMBL8764352 0.77 NPC1 (0.46) MMP2MMP9MMP13MMP1
SCHEMBL8764317 0.77 PLCG1 (0.67) MMP2MMP9MMP13TP53MMP1
SCHEMBL8764344 0.77 MMP1 (0.49) MMP3BCHEACHEMMP1KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0606756-B1 Use of disulfonyl methanes for the control of parasites LILLY CO ELI (US) 1997-07-23 EP claimed
US-5637603-A FORMULATION WHICH PROTECTS VERTEBRATE ANIMALS AGAINST PARASITES ELI LILLY AND COMPANY (US) 1997-06-10 US claimed
US-5449681-A Administering by mouth or injection; anthelmintics, insecticides ELI LILLY AND COMPANY (US) 1995-09-12 US claimed
EP-0606756-A1 Use of disulfonyl methanes for the control of parasites ELI LILLY AND COMPANY (US) 1994-07-20 EP claimed
EP-0606756-B1 Use of disulfonyl methanes for the control of parasites LILLY CO ELI (US) 1997-07-23 EP disclosed
US-5637603-A FORMULATION WHICH PROTECTS VERTEBRATE ANIMALS AGAINST PARASITES ELI LILLY AND COMPANY (US) 1997-06-10 US disclosed
US-5614525-A ANTHELMINTICS ELI LILLY AND COMPANY (US) 1997-03-25 US disclosed
US-5596122-A INSECTICIDES AND LARVICIDES ELI LILLY AND COMPANY (US) 1997-01-21 US disclosed
US-5449681-A Administering by mouth or injection; anthelmintics, insecticides ELI LILLY AND COMPANY (US) 1995-09-12 US disclosed
EP-0606756-A1 Use of disulfonyl methanes for the control of parasites ELI LILLY AND COMPANY (US) 1994-07-20 EP disclosed