SCHEMBL6454677

SCHEMBL6454677

COCC(=O)N1C(=O)OCC1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.46
FAAH O00519 1/20 0.43
ALDH1A1 P00352 1/20 0.43
IDH1 O75874 8/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CYP2D6 P10635 1/20 0.40
PPARA Q07869 1/20 0.40
IL6ST P40189 1/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 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
SCHEMBL5022256 1.00 NAAA (0.46) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL8674159 0.90 NAAA (0.43) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL8007307 0.90 NAAA (0.43) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL1750168 0.90 ALDH1A1 (0.55) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL1750169 0.90 ALDH1A1 (0.55) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL9970285 0.87 GRM5 (0.46) NAAAFAAHALDH1A1IDH1
SCHEMBL3308451 0.87 GRM5 (0.46) NAAAFAAHALDH1A1IDH1
SCHEMBL3308447 0.87 GRM5 (0.46) NAAAFAAHALDH1A1IDH1
SCHEMBL6442419 0.86 ALDH1A1 (0.46) NAAAFAAHALDH1A1IDH1CSNK2B
SCHEMBL4327486 0.86 PPARA (0.44) NAAAFAAHALDH1A1IDH1CSNK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1572203-A1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-14 EP disclosed
WO-2004041275-A1 SUBSTITUTED 4-ALKOXYOXAZOL DERIVATIVES AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-05-21 WO disclosed
EP-1392295-A1 CARBOXYLIC ACID SUBSTITUTED OXAZOLE DERIVATIVES FOR USE AS PPAR-ALPHA AND -GAMMA ACTIVATORS IN THE TREATMENT OF DIABETES F. Hoffmann-La Roche AG (CH) 2004-03-03 EP disclosed
WO-2002092084-A1 CARBOXYLIC ACID SUBSTITUTED OXAZOLE DERIVATIVES FOR USE AS PPAR-ALPHA AND -GAMMA ACTIVATORS IN THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2002-11-21 WO disclosed