SCHEMBL15314152

SCHEMBL15314152

CC[C@H](C(=O)N(C)C)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
SHBG P04278 1/20 0.35
GAA P10253 1/20 0.33
ALOX5 P09917 1/20 0.32
CPN1 P15169 1/20 0.32
CPB2 Q96IY4 1/20 0.32
DPP4 P27487 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
SCHEMBL5967397 0.75
SCHEMBL6270743 0.75
SCHEMBL19691156 0.73
SCHEMBL15314117 0.70 ALOX5 (0.40) CHRNB2CHRNB4CHRNA3CHRNA4ALOX5
SCHEMBL855305 0.69
SCHEMBL21785106 0.69
SCHEMBL861919 0.69
SCHEMBL20838931 0.68 SHBG (0.54) SHBGCPN1CPB2
SCHEMBL2308188 0.68 SHBG (0.54) SHBGCPN1CPB2
SCHEMBL17731364 0.68 SHBG (0.54) SHBGCPN1CPB2

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-8557765-B2 Spatially-defined macrocycles incorporating peptide bond surrogates TRANZYME PHARMA INC. (CA) 2013-10-15 US disclosed