SCHEMBL6867263

SCHEMBL6867263

CCCCCCNC(=O)NCCC(N)=O

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.73
CASP2 P42575 1/20 0.55
EPHX2 P34913 8/20 0.54
NAAA Q02083 1/20 0.52

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
SCHEMBL15224160 0.92 EPHX1 (0.63) EPHX1CASP2EPHX2
SCHEMBL25225212 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25226893 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25271007 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25227881 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25277850 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25225195 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25270721 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25278283 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25228721 0.85 EPHX1 (1.00) EPHX1CASP2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1452522-A2 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2004-09-01 EP disclosed