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Sulfamide

Sulfamide

SCHEMBL7145910

COc1ccc(-c2cc(C(F)(F)F)nn2-c2ccccc2)cc1F.NS(N)(=O)=O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 13/20 0.67
▸ PTGS1 P23219 8/20 0.65
▸ ABCB11 O95342 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ PDPK1 O15530 2/20 0.58
▸ MAPT P10636 3/20 0.56
▸ POLB P06746 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56

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
Hydrogen Sulfide SCHEMBL27507737 0.92 PTGS1 (0.61) PTGS2PTGS1ABCB11ALDH1A1MAPT
SCHEMBL213124 0.89 PTGS2 (0.84) PTGS2PTGS1ABCB11ALDH1A1PDPK1
SCHEMBL13945111 0.85 PTGS2 (0.67) PTGS2PTGS1ABCB11ALDH1A1
SCHEMBL7920280 0.85 PTGS2 (0.58) PTGS2PTGS1ABCB11ALDH1A1PDPK1
Sulfamide SCHEMBL7135579 0.84 PTGS2 (0.79) PTGS2PTGS1PDPK1
Sulfamide SCHEMBL7134988 0.83 PTGS2 (0.79) PTGS2PTGS1ABCB11ALDH1A1
SCHEMBL6722421 0.82 PDPK1 (0.66) PTGS2PTGS1PDPK1
SCHEMBL6350722 0.82 PTGS2 (0.72) PTGS2PTGS1ABCB11ALDH1A1PDPK1
Sulfamide SCHEMBL7135598 0.82 PTGS2 (0.77) PTGS2PTGS1ABCB11PDPK1
SCHEMBL8331025 0.82 PTGS2 (0.60) PTGS2PTGS1ABCB11ALDH1A1

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-0854723-B1 SUBSTITUTED PYRAZOLYL BENZENESULFONAMIDES FOR USE IN VETERINARY THERAPIES AS ANTIINFLAMMATORY AGENTS SEARLE & CO (US) 2003-04-23 — — EP claimed