SCHEMBL4062303

SCHEMBL4062303

CC1(C)OC[C@H](C(N)CO)O1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34

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
SCHEMBL1944725 1.00 CA2 (0.34) CA2
SCHEMBL1222860 1.00 CA2 (0.34) CA2
SCHEMBL1946817 1.00 CA2 (0.34) CA2
SCHEMBL1946172 1.00 CA2 (0.34) CA2
SCHEMBL1222856 1.00 CA2 (0.34) CA2
SCHEMBL27777151 1.00 CA2 (0.34) CA2
SCHEMBL27756454 0.85 CA2 (0.33) CA2
Benzoic Acid SCHEMBL1223233 0.82 TMEM97 (0.38)
Benzoic Acid SCHEMBL1221791 0.82 TMEM97 (0.38)
Benzoic Acid SCHEMBL1221787 0.82 TMEM97 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101528749-B Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases IND RES LTD 2013-07-31 CN disclosed
WO-2008030119-A9 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES INDUSTRIAL RESEARCH LIMITED (NZ) 2009-09-24 WO disclosed
CN-101528749-A Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases IND RES LTD (NZ) 2009-09-09 CN disclosed
EP-2057165-A1 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES INDUSTRIAL RESEARCH LIMITED (NZ) 2009-05-13 EP disclosed
WO-2008030119-A1 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES INDUSTRIAL RESEARCH LIMITED (NZ) 2008-03-13 WO disclosed