SCHEMBL11828599

SCHEMBL11828599

CCOC(=O)C(CCc1ccc(-c2ccccc2Cl)cc1)S(=O)(=O)S

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.43
▸ HCAR2 Q8TDS4 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TNF P01375 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ CCR6 P51684 1/20 0.39
▸ RUNX1 Q01196 1/20 0.39
▸ CBFB Q13951 1/20 0.39
▸ HKDC1 Q2TB90 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NOD2 Q9HC29 1/20 0.39
▸ GPR35 Q9HC97 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39
▸ GRM6 O15303 1/20 0.38
▸ PTPN1 P18031 1/20 0.38

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
SCHEMBL11824134 0.82 MAOB (0.48) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11824437 0.82 MAOB (0.48) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11828131 0.81 MAOB (0.50) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11827746 0.81 MAOB (0.47) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11823591 0.81 MAOB (0.47) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11839776 0.79 PGR (0.40) KDM4EALDH1A1TNFLMNAHSP90AA1
SCHEMBL11830154 0.77 MAOB (0.48) MAOBHCAR2MAPTMMESMN1; SMN2
SCHEMBL11826267 0.76 MAOB (0.49) MAOBHCAR2FFAR1MME
SCHEMBL11837690 0.76 MAOB (0.41) MAOBHCAR2KDM4EALDH1A1TNF
SCHEMBL11830204 0.76 MAOB (0.41) MAOBHCAR2KDM4EALDH1A1TNF

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
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 — — US disclosed
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