SCHEMBL2442836

SCHEMBL2442836

CCOC(=O)C=Cc1cccc(OC(C)(C)C(=O)OC(C)(C)C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.59
TTR P02766 1/20 0.48
DPP4 P27487 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PPARA Q07869 3/20 0.46
PPARG P37231 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MAOB P27338 1/20 0.44
CYP3A4 P08684 2/20 0.43
FDPS P14324 1/20 0.43
HCRTR1 O43613 1/20 0.43
ALOX5 P09917 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL6543956 1.00 FBP1 (0.59) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL19244366 0.88 TTR (0.55) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL19244365 0.88 TTR (0.55) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL6543092 0.87 FBP1 (0.57) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL2435547 0.87 FBP1 (0.57) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL1879100 0.82 TTR (0.57) TTRDPP4KDM4EALDH1A1SMN1; SMN2
SCHEMBL1895095 0.82 MAPT (0.53) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL1895094 0.82 MAPT (0.53) FBP1TTRDPP4KDM4EALDH1A1
SCHEMBL21188478 0.80 CYP3A4 (0.46) FBP1TTRDPP4PPARAPPARG
SCHEMBL19244446 0.79 KDM4E (0.47) FBP1KDM4EALDH1A1SMN1; SMN2MAOB

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
EP-1433786-B1 Benzoxazole compound and pharmaceutical composition containing the compound KOWA CO (JP) 2011-09-21 EP disclosed
EP-1433786-A1 Benzoxazole compound and pharmaceutical composition containing the compound Kowa Company Ltd. (JP) 2004-06-30 EP disclosed