SCHEMBL20366268

SCHEMBL20366268

CCCCCC(=O)NC(CCNC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 10/20 0.57
MEN1 O00255 1/20 0.52
GAA P10253 1/20 0.52
KMT2A Q03164 1/20 0.52
SLC6A5 Q9Y345 1/20 0.47
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
EPHX2 P34913 3/20 0.46
CAPN1 P07384 1/20 0.46
FOLH1 Q04609 1/20 0.45
GLP1R P43220 2/20 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
SCHEMBL29187400 0.91 NOD1 (0.60) NOD1MEN1GAAKMT2ASLC6A5
SCHEMBL25542921 0.91 NOD1 (0.60) NOD1MEN1GAAKMT2ASLC6A5
SCHEMBL22640886 0.89 NOD1 (0.61) NOD1MEN1GAAKMT2ASLC6A5
SCHEMBL13434505 0.86 LPAR3 (0.56) NOD1MEN1GAAKMT2ACTSS
SCHEMBL20398934 0.86 SLC6A5 (0.62) NOD1MEN1GAAKMT2ASLC6A5
SCHEMBL22684548 0.86 NOD1 (0.55) NOD1MEN1GAAKMT2ASLC6A5
SCHEMBL31601080 0.86 MEN1 (0.57) NOD1MEN1GAAKMT2AEPHX2
SCHEMBL20398932 0.85 SLC6A5 (0.64) NOD1SLC6A5EPHX2GLP1R
SCHEMBL20398922 0.85 SLC6A5 (0.64) NOD1SLC6A5EPHX2GLP1R
SCHEMBL19809682 0.85 SLC6A5 (0.64) NOD1SLC6A5EPHX2GLP1R

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-2018128826-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF BACTERIAL INFECTIONS CIDARA THERAPEUTICS, INC. (US) 2018-07-12 WO disclosed