Darbufelone

Darbufelone

SCHEMBL8526046

CC(C)(C)c1cc(/C=C2/SC(=N)NC2=O)cc(C(C)(C)C)c1O

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 11/20 0.75
▸ PTGS1 P23219 7/20 0.75
▸ MRE11 P49959 1/20 0.57
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ ALOX5 P09917 1/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ POLB P06746 1/20 0.53

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
Darbufelone SCHEMBL452951 1.00 PTGS2 (0.75) PTGS2PTGS1MRE11CYP1A2CYP2C9
Darbufelone SCHEMBL452950 1.00 PTGS2 (0.75) PTGS2PTGS1MRE11CYP1A2CYP2C9
Darbufelone SCHEMBL2683037 0.94 PTGS2 (0.67) PTGS2PTGS1MRE11CYP1A2CYP2C9
SCHEMBL8962138 0.86 PTGS2 (1.00) PTGS2PTGS1GAAALOX5
SCHEMBL3667216 0.86 PTGS2 (1.00) PTGS2PTGS1GAAALOX5
SCHEMBL3667218 0.86 PTGS2 (1.00) PTGS2PTGS1GAAALOX5
SCHEMBL8618544 0.83 PTGS2 (1.00) PTGS2PTGS1GAAMEN1KMT2A
SCHEMBL7768284 0.83 PTGS2 (1.00) PTGS2PTGS1GAAMEN1KMT2A
SCHEMBL8309757 0.83 PTGS2 (1.00) PTGS2PTGS1GAAMEN1KMT2A
SCHEMBL8492533 0.82 PTGS2 (0.51) PTGS2PTGS1MRE11CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0914122-A1 METHOD FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS BY ADMINISTERING A THIAZOLIDINONE WARNER-LAMBERT COMPANY (US) 1999-05-12 — — EP claimed
WO-1998002160-A1 METHOD FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS BY ADMINISTERING A THIAZOLIDINONE WARNER-LAMBERT COMPANY (US) 1998-01-22 — — WO claimed
EP-0449216-B1 3,5-di-tertiarybutyl-4-hydroxyphenylmethylene derivatives of 2-substituted thiazolidinones, oxazolidinones, and imidazolidinones as antiinflammatory agents WARNER LAMBERT CO (US) 1996-02-07 — — EP claimed
US-5143928-A Inhibitors of cyclooxygenase and lipoxygenase WARNER-LAMBERT COMPANY (US) 1992-09-01 — — US claimed
EP-0449216-A1 3,5-di-tertiarybutyl-4-hydroxyphenylmethylene derivatives of 2-substituted thiazolidinones, oxazolidinones, and imidazolidinones as antiinflammatory agents WARNER-LAMBERT COMPANY (US) 1991-10-02 — — EP claimed
EP-0914122-A1 METHOD FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS BY ADMINISTERING A THIAZOLIDINONE WARNER-LAMBERT COMPANY (US) 1999-05-12 — — EP disclosed
WO-1998002160-A1 METHOD FOR TREATING AND PREVENTING NEURODEGENERATIVE DISORDERS BY ADMINISTERING A THIAZOLIDINONE WARNER-LAMBERT COMPANY (US) 1998-01-22 — — WO disclosed
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