SCHEMBL28732002

SCHEMBL28732002

COC(COC(=O)NS(N)(=O)=O)OC

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
PGGT1B P53609 1/20 0.41
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL19813050 0.74 CHRNB2 (0.42)
SCHEMBL530163 0.74 FNTA (0.46) FNTAFNTBPGGT1BCA1CA2
SCHEMBL13824717 0.73
Water SCHEMBL5481689 0.71 FNTA (0.39) FNTAFNTBPGGT1BCA1CA2
SCHEMBL7603527 0.69 ALOX15 (0.46)
SCHEMBL6276297 0.69 MGAM (0.46)
SCHEMBL2349139 0.68 ALDH1A1 (0.41)
SCHEMBL3412967 0.68 EPHX1 (0.48) CA1CA2
SCHEMBL28732026 0.67
SCHEMBL10283712 0.67 FNTA (0.41) FNTAFNTBPGGT1BCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109810104-B Method for synthesizing indoleamine 2, 3-dioxygenase inhibitors 因赛特控股公司 2022-05-03 CN disclosed