SCHEMBL8459121

SCHEMBL8459121

NC(c1ccccc1)C(NS(N)(=O)=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.48
▸ CA1 P00915 6/20 0.41
▸ CA2 P00918 6/20 0.41
▸ GBA1 P04062 1/20 0.39
▸ F2 P00734 1/20 0.38
▸ ACHE P22303 2/20 0.38
▸ CA12 O43570 3/20 0.37
▸ CA14 Q9ULX7 3/20 0.37
▸ CA7 P43166 2/20 0.37
▸ AOC3 Q16853 1/20 0.37
▸ CA9 Q16790 2/20 0.35
▸ CA3 P07451 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA6 P23280 1/20 0.35
▸ CA5A P35218 1/20 0.35
▸ PLA2G7 Q13093 1/20 0.35
▸ CA13 Q8N1Q1 1/20 0.35
▸ CA5B Q9Y2D0 1/20 0.35
▸ SLC1A3 P43003 2/20 0.34
▸ SLC1A2 P43004 2/20 0.34

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
SCHEMBL10193903 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL2844004 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL809956 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL2840860 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL990226 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL3856755 0.83 DPP4 (0.46) DPP4GBA1F2AOC3SLC1A3
SCHEMBL2067895 0.81 GBA1 (0.51) DPP4CA1CA2GBA1CA12
SCHEMBL7091245 0.81 DPP4 (0.45) DPP4GBA1F2AOC3SLC1A3
Benzene SCHEMBL4865907 0.81 DPP4 (0.45) DPP4GBA1F2AOC3SLC1A3
SCHEMBL3852094 0.81 GBA1 (0.51) DPP4CA1CA2GBA1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0949243-A1 OPTICALLY ACTIVE METHOXYIMINOACETAMIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF THEM, INTERMEDIATES THEREFOR, AND PESTICIDES CONTAINING THEM AS THE ACTIVE INGREDIENT MITSUBISHI CHEMICAL CORPORATION (JP) 1999-10-13 — — EP claimed
EP-0949243-A1 OPTICALLY ACTIVE METHOXYIMINOACETAMIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF THEM, INTERMEDIATES THEREFOR, AND PESTICIDES CONTAINING THEM AS THE ACTIVE INGREDIENT MITSUBISHI CHEMICAL CORPORATION (JP) 1999-10-13 — — EP disclosed
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