SCHEMBL1963765

SCHEMBL1963765

CC(C)(C)OC(=O)C1(C(=O)OC(C)(C)CN)CCCN1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 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
SCHEMBL9518563 0.80 CYP4F2 (0.32) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL28779766 0.78 GRIN2B (0.36) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL8663550 0.74 GRIN2B (0.36) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL7382306 0.70 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL2216266 0.70 HPGD (0.33) CYP4F2CYP4A11
SCHEMBL8585741 0.70 HPGD (0.33) CYP4F2CYP4A11
SCHEMBL630080 0.70 GRIN2B (0.38) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL8484892 0.70 JAK3 (0.33) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL19281600 0.70 CYP4F2 (0.35) GRIN2BGRIN2CCYP4F2CYP4A11
SCHEMBL28905835 0.69 GRIN2B (0.40) GRIN2BGRIN2C

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
EP-2509942-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES Johns Hopkins University (US) 2012-10-17 EP disclosed
WO-2011071947-A2 BIS-ACYLATED HYDROXYLAMINE DERIVATIVES JOHNS HOPKINS UNIVERSITY (US) 2011-06-16 WO disclosed