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Sugi Predict / Compounds / Methanesulfonamide

Methanesulfonamide

Methanesulfonamide

SCHEMBL11097510

CS(N)(=O)=O.NCCCC[C@H](N)C(=O)N1CCC[C@]1(C(=O)O)C(CCc1ccccc1)C(=O)O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP8 Q6V1X1 3/20 0.39
▸ DPP7 Q9UHL4 3/20 0.39
▸ DPP9 Q86TI2 1/20 0.39
▸ ACE P12821 2/20 0.39
▸ OPRK1 P41145 1/20 0.36
▸ LNPEP Q9UIQ6 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ PLAU P00749 2/20 0.35
▸ PLAUR Q03405 2/20 0.35
▸ CPB2 Q96IY4 1/20 0.34
▸ THRB P10828 1/20 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
SCHEMBL649164 0.94 DPP8 (0.43) DPP8DPP7DPP9ACEOPRK1
SCHEMBL5552493 0.94 DPP8 (0.43) DPP8DPP7DPP9ACEOPRK1
Water SCHEMBL3369508 0.94 DPP7 (0.42) DPP8DPP7DPP9ACEOPRK1
SCHEMBL10883512 0.92 DPP7 (0.39) DPP8DPP7DPP9ACEMMP2
SCHEMBL7266941 0.86 ACE (0.42) DPP8DPP7DPP9ACEOPRK1
SCHEMBL5551908 0.82 DPP8 (0.40) DPP8DPP7DPP9ACELNPEP
SCHEMBL9394613 0.82 ACE (0.40) ACELNPEP
SCHEMBL7318606 0.81 DPP7 (0.43) DPP8DPP7DPP9
SCHEMBL10887856 0.80 DPP7 (0.37) DPP8DPP7DPP9
SCHEMBL11242902 0.78 ACE (0.37) ACECPB2

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
EP-0099709-A2 Amide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-02-01 — — EP disclosed