SCHEMBL5308495

SCHEMBL5308495

C#CC(C)(C)Oc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.55
PPARG P37231 4/20 0.51
PPARA Q07869 3/20 0.49
FABP2 P12104 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
ALDH1A1 P00352 1/20 0.45
STS P08842 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL5308792 0.87 ELANE (0.57) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL5281549 0.81 ELANE (0.64) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL18405594 0.80 CA4 (0.39) ELANEPPARGPPARAALDH1A1
SCHEMBL14139184 0.79 ELANE (0.62) ELANEALDH1A1STS
SCHEMBL11441192 0.78 PPARG (0.76) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL5308750 0.78 LTA4H (0.47) PPARGPPARAALDH1A1
SCHEMBL29038424 0.77 ELANE (0.49) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL23544179 0.77 ELANE (0.55) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL22295633 0.77 SRD5A2 (0.61) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL27607343 0.77 ELANE (0.58) ELANEPPARGPPARAFABP2SLC22A12

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
WO-2007039609-A1 PYRANODIBENZOFURAN DERIVATIVES WITH ANTIFUNGAL AND ANTIBACTERIAL ACTIVITY INSTITUT PASTEUR (FR) 2007-04-12 WO disclosed
EP-0355565-A1 6-Benzoyl-substituted 3,4-dihydro-2H-benzopyranes, method for their preparation and pharmaceutical preparations based on these compounds HOECHST AKTIENGESELLSCHAFT (DE) 1990-02-28 EP disclosed