SCHEMBL2435547

SCHEMBL2435547

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.57
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TTR P02766 1/20 0.51
DPP4 P27487 1/20 0.51
PPARG P37231 7/20 0.48
PPARA Q07869 7/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
MAOB P27338 1/20 0.47
CYP3A4 P08684 1/20 0.46
PTGS2 P35354 1/20 0.46
FDPS P14324 1/20 0.45
HTT P42858 1/20 0.45
HCRTR1 O43613 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
SCHEMBL6543092 1.00 FBP1 (0.57) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL19244365 0.88 TTR (0.55) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL19244366 0.88 TTR (0.55) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL6543956 0.87 FBP1 (0.59) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL2442836 0.87 FBP1 (0.59) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL1895094 0.85 MAPT (0.53) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL1895095 0.85 MAPT (0.53) FBP1KDM4EALDH1A1SMN1; SMN2TTR
SCHEMBL9643718 0.82 ALOX5 (0.62) KDM4EALDH1A1SMN1; SMN2TTRDPP4
SCHEMBL9643721 0.82 ALOX5 (0.62) KDM4EALDH1A1SMN1; SMN2TTRDPP4
SCHEMBL9599969 0.81 KDM4E (0.74) KDM4EALDH1A1SMN1; SMN2TTRDPP4

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 3 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
US-6653334-B1 Electively activate peroxisome proliferator activated receptors KOWA CO., LTD. (JP) 2003-11-25 US disclosed