SCHEMBL7673133

SCHEMBL7673133

COC(=O)C1C(COC(C)=O)OC(=O)N1C(C)c1cccc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 2/20 0.37
HSD11B1 P28845 1/20 0.37
CASR P41180 1/20 0.35
NPBWR1 P48145 1/20 0.35
XIAP P98170 2/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PAX8 Q06710 1/20 0.35

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
SCHEMBL7668438 0.88 GPR139 (0.39) GPR139HSD11B1CASRXIAP
SCHEMBL7670061 0.88 GPR139 (0.39) GPR139HSD11B1CASRXIAPALDH1A1
SCHEMBL7672137 0.86 CYP1A2 (0.39) GPR139HSD11B1CASRXIAP
SCHEMBL7685510 0.86 CASP1 (0.39) GPR139HSD11B1CASR
SCHEMBL7669920 0.83 METAP2 (0.41) GPR139HSD11B1CASRXIAPALDH1A1
SCHEMBL7663146 0.83 METAP2 (0.41) GPR139HSD11B1CASRXIAPALDH1A1
SCHEMBL7668243 0.83 KDM4E (0.42) GPR139HSD11B1L3MBTL1
SCHEMBL7671032 0.82 HSD11B1 (0.41) GPR139HSD11B1CASRXIAPALDH1A1
SCHEMBL7674018 0.82 HSD11B1 (0.41) GPR139HSD11B1CASRXIAPALDH1A1
SCHEMBL7668338 0.82 HSD11B1 (0.41) GPR139HSD11B1CASRXIAP

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
US-6414160-B1 REACTING 5-ALKOXY-2(3H)OXAZOLONE COMPOUND WITH ALDEHYDE COMPOUND IN PRESENCE OF LEWIS ACID CATALYST UBE INDUSTRIES, LTD. (JP) 2002-07-02 US disclosed
EP-1000937-A1 PROCESS FOR PRODUCING 4-ALKOXYCARBONYL-2-OXAZOLIDINONE COMPOUNDS UBE INDUSTRIES LIMITED (JP) 2000-05-17 EP disclosed