SCHEMBL4817994

SCHEMBL4817994

CC(C)(C)OC(=O)N[C@@H]1CCC(=O)N(OCc2ccccc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.48
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NPY1R P25929 1/20 0.45
MME P08473 3/20 0.42
ACE P12821 3/20 0.42
DRD2 P14416 2/20 0.41

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
SCHEMBL4816939 1.00 SCN9A (0.48) SCN9AKMT2AL3MBTL1NPY1RMME
SCHEMBL24379309 1.00 SCN9A (0.48) SCN9AKMT2AL3MBTL1NPY1RMME
SCHEMBL4698131 0.90 KMT2A (0.47) SCN9AKMT2AL3MBTL1
SCHEMBL4700532 0.90 KMT2A (0.47) SCN9AKMT2AL3MBTL1
SCHEMBL9655226 0.82 KMT2A (0.48) SCN9AKMT2AL3MBTL1NPY1RDRD2
SCHEMBL9655228 0.82 KMT2A (0.48) SCN9AKMT2AL3MBTL1NPY1RDRD2
SCHEMBL7420003 0.82 SCN9A (0.47) SCN9AKMT2AL3MBTL1NPY1RMME
SCHEMBL19027637 0.81 KMT2A (0.50) SCN9AKMT2AL3MBTL1NPY1RACE
SCHEMBL18870010 0.80 ALDH1A1 (0.51) SCN9AKMT2AL3MBTL1NPY1R
SCHEMBL7768791 0.80 KMT2A (0.49) SCN9AKMT2AL3MBTL1NPY1RMME

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-7325355-B2 Methods for treatment of atherosclerosis using 1,3-dioxo-2-(2,6-dioxopiperidin-3-yl)-4-aminoisoindoline CELGENE CORPORATION (US) 2008-02-05 US disclosed
US-5635517-A Method of reducing TNFα levels with amino substituted 2-(2,6-dioxopiperidin-3-yl)-1-oxo-and 1,3-dioxoisoindolines CELGENE CORPORATION (US) 1997-06-03 US disclosed