SCHEMBL8764355

SCHEMBL8764355

O=S(=O)(CS(=O)(=O)C(F)(F)F)c1ccc(Cl)c(Cl)c1.O=S(=O)(c1ccc(Cl)c(Cl)c1)C(Cl)(Cl)S(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 2/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 1/20 0.33
ESPL1 Q14674 1/20 0.33
HSD11B1 P28845 2/20 0.32
CA2 P00918 1/20 0.32
APEX1 P27695 1/20 0.32
NFE2L2 Q16236 2/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL8764409 0.87 ALDH1A1 (0.41) EPAS1KMT2AMEN1ALDH1A1MAPK1
SCHEMBL8764883 0.87 EPAS1 (0.46) EPAS1KMT2AMEN1ALDH1A1ESPL1
SCHEMBL8763338 0.76 SOS1 (0.41) EPAS1KMT2AMEN1CA2
SCHEMBL8764952 0.72 CA1 (0.45) ALDH1A1MAPK1CA2APEX1
SCHEMBL8764347 0.71 VCAM1 (0.55) ALDH1A1
SCHEMBL8764352 0.70 NPC1 (0.46) KMT2AMEN1ALDH1A1MAPK1HSD11B1
SCHEMBL11818075 0.69 CA2 (0.43) EPAS1KMT2ACA2APEX1NFE2L2
SCHEMBL8764348 0.67 SOD1 (0.41) EPAS1
SCHEMBL8764306 0.66 CDK1 (0.38) CA2
SCHEMBL6856388 0.65 LMNA (0.49) ALDH1A1CA2LMNA

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-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