SCHEMBL5842735

SCHEMBL5842735

CCC(NC(=O)C(C)c1ccccc1)C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.55
GPR88 Q9GZN0 11/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPY1R P25929 2/20 0.44
FCER2 P06734 1/20 0.44
NPY5R Q15761 1/20 0.44

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
SCHEMBL5842741 1.00 MME (0.55) MMEGPR88MEN1KMT2ANPY1R
SCHEMBL11904819 0.83 MME (0.57) MMEGPR88MEN1KMT2A
SCHEMBL16050234 0.81 NPY1R (0.48) MMEGPR88NPY1R
SCHEMBL5285091 0.80 ECE1 (0.52) MMEGPR88
SCHEMBL7374278 0.78 MME (0.71) MMEGPR88
SCHEMBL5283204 0.78 KMT2A (0.56) MMEGPR88KMT2A
SCHEMBL17161710 0.78 MEN1 (0.53) MMEMEN1KMT2A
SCHEMBL6138235 0.78 MME (0.56) MMEGPR88
SCHEMBL11196738 0.76 GPR88 (0.50) GPR88MEN1KMT2A
SCHEMBL8016181 0.76 GPR88 (0.53) MMEGPR88MEN1KMT2A

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
US-7109243-B2 Inhibitors of cathepsin S IRM LLC (BM) 2006-09-19 US claimed