SCHEMBL8906097

SCHEMBL8906097

CCC(C)OC(=O)C(CC)(CC)P(=O)(O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
FDPS P14324 1/20 0.32
PTPN1 P18031 1/20 0.31

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
SCHEMBL11529906 0.85 PTPN1 (0.41) MMP1MMP2MMP3FDPSPTPN1
SCHEMBL6931264 0.79
SCHEMBL337595 0.74 MMP1 (0.34) MMP1MMP2MMP3FDPSPTPN1
SCHEMBL18759662 0.72 CYP4F2 (0.40)
SCHEMBL2982491 0.72 MAPT (0.33)
SCHEMBL4406928 0.72 MAPT (0.33)
SCHEMBL2984810 0.72 MAPT (0.33)
SCHEMBL16048 0.72 CYP4F2 (0.40)
SCHEMBL9578846 0.72 FDPS (0.32) FDPS
SCHEMBL2479166 0.71 PRKCA (0.44)

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
US-5616586-A Tricyclic quinoxalinediones SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-04-01 US disclosed
EP-0642508-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1995-03-15 EP disclosed
WO-1993008188-A1 TRICYCLIC QUINOXALINEDIONES AS GLUTAMATE RECEPTOR ANTAGONISTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-04-29 WO disclosed