SCHEMBL23685282

SCHEMBL23685282

CC(O)CC(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
CYP2D6 P10635 1/20 0.38
REN P00797 1/20 0.36
CAPN1 P07384 1/20 0.36
CCKBR P32239 1/20 0.36
KLK5 Q9Y337 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CTSK P43235 3/20 0.35
CTSS P25774 2/20 0.35
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35

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
SCHEMBL20366152 0.87 KLK5 (0.45) MEN1GAAKMT2ATDP1CYP2D6
SCHEMBL20366014 0.83 MEN1 (0.44) MEN1GAAKMT2AMAOAMAOB
SCHEMBL25458901 0.80 NMT2 (0.45) MEN1GAAKMT2AMAOAMAOB
SCHEMBL18736992 0.79 MEN1 (0.51) MEN1GAAKMT2AMAOAMAOB
SCHEMBL25458905 0.77 NOD1 (0.37)
SCHEMBL2368382 0.76 MEN1 (0.59) MEN1GAAKMT2AMAOAMAOB
SCHEMBL5761580 0.76 MEN1 (0.59) MEN1GAAKMT2AMAOAMAOB
SCHEMBL12598786 0.76 MEN1 (0.59) MEN1GAAKMT2AMAOAMAOB
SCHEMBL26789986 0.76 MEN1 (0.60) MEN1GAAKMT2AMAOAMAOB
SCHEMBL19033286 0.75 MEN1 (0.55) MEN1GAAKMT2AMAOAMAOB

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-2021150792-A1 NOVEL COMPOUNDS AND COMPOSITION FOR TARGETED THERAPY OF KIDNEY-ASSOCIATED CANCERS MICURX PHARMACEUTICALS, INC. (US) 2021-07-29 WO disclosed