SCHEMBL8764978

SCHEMBL8764978

O=S(=O)(CS(=O)(=O)C(F)(F)F)c1ccc(Cl)cc1.O=S(=O)(CS(=O)(=O)C(F)(F)F)c1cccc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP8 P22894 1/20 0.44
MMP13 P45452 1/20 0.44
KDM1A O60341 2/20 0.44
CNR2 P34972 1/20 0.44
POLB P06746 1/20 0.43
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
DDR1 Q08345 1/20 0.40
PPARG P37231 3/20 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
SCHEMBL8763360 0.90 CA1 (0.53) RECQLCA1CA2MMP1MMP2
SCHEMBL8764352 0.84 NPC1 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL10919387 0.78 HSD11B1 (0.54) CA1CA2MMP1MMP2MMP9
SCHEMBL8764344 0.77 MMP1 (0.49) CA1CA2MMP1KMT2A
SCHEMBL12542296 0.75 CNR2 (0.52) RECQLCA1CA2MMP1MMP2
SCHEMBL8763301 0.74 CES2 (0.41) CA1CA2MMP1MMP2MMP9
SCHEMBL8764400 0.74 PSIP1 (0.50) CA1CA2POLBKMT2A
SCHEMBL8763338 0.74 SOS1 (0.41) CA2CNR2KMT2AMEN1
SCHEMBL8764409 0.73 ALDH1A1 (0.41) CA2CYP3A4CYP2C19CYP2D6CYP2C9
SCHEMBL8385129 0.73 CA1 (0.57) RECQLCA1CA2MMP1MMP2

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 3 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-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