SCHEMBL18174176

SCHEMBL18174176

CC(=O)N(I)C(CC(C)C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 1/20 0.40
SLC7A5 Q01650 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CPA1 P15085 2/20 0.37
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC1A1 P43005 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
CACNA2D1 P54289 2/20 0.31
CACNB3 P54284 1/20 0.31
CACNA1C Q13936 1/20 0.31
PGR P06401 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CACNA2D2 Q9NY47 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
SCHEMBL8373941 0.80 RNPEP (0.44) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL8373938 0.80 RNPEP (0.44) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL19858949 0.78 RNPEP (0.43) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL19858948 0.78 RNPEP (0.43) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL2454573 0.77 KDM4E (0.38) MAPT
SCHEMBL23182436 0.77 RNPEP (0.46) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL27094307 0.77 RNPEP (0.41) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL11161410 0.77 RNPEP (0.46) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL27094306 0.77 RNPEP (0.41) RNPEPSLC7A5ALDH1A1CPA1SLC1A3
SCHEMBL244271 0.73 RNPEP (0.52) RNPEPSLC7A5ALDH1A1CPA1SLC1A3

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-3286168-A1 A SOLID FORM OF APREMILAST AND A PROCESS FOR PREPARING THE SAME Zentiva K.S. (CZ) 2018-02-28 EP disclosed
WO-2016169533-A1 A SOLID FORM OF APREMILAST AND A PROCESS FOR PREPARING THE SAME ZENTIVA, K.S. (CZ) 2016-10-27 WO disclosed