SCHEMBL10202115

SCHEMBL10202115

CC[C@]1(C)CCCN1C(=O)CNC(=O)OC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL10202119 0.81 DPP4 (0.34) DPP4
SCHEMBL10202099 0.78 ALDH1A1 (0.39) MEN1ALDH1A1TSHRKMT2A
SCHEMBL16563024 0.78 MEN1 (0.32) MEN1ALDH1A1TSHRKMT2A
SCHEMBL10187036 0.78 DPP4 (0.33) DPP4ALDH1A1
SCHEMBL10202326 0.78 USP2 (0.38) DPP4ALDH1A1TSHR
SCHEMBL10203871 0.77 ALDH1A1 (0.37) DPP4MEN1ALDH1A1KMT2A
SCHEMBL10202114 0.76 DPP4 (0.36) DPP4
SCHEMBL10202109 0.74 ALDH1A1 (0.38) DPP4ALDH1A1
SCHEMBL10202106 0.72 ALDH1A1 (0.41) MEN1ALDH1A1TSHRKMT2A
SCHEMBL16518666 0.72 DPP4 (0.35) DPP4

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
WO-2012061552-A1 NOVEL INHIBITORS OF HEPATITIS C VIRUS THERAVANCE, INC. (US) 2012-05-10 WO disclosed