SCHEMBL18734952

SCHEMBL18734952

CCOC(=O)CC(=O)C(=O)SC(C)C(NC(=O)CC)C(=O)N(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL18734959 0.90 — —
SCHEMBL18734958 0.88 MGAM (0.33) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18734963 0.88 — —
SCHEMBL18735191 0.88 GAA (0.35) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735343 0.86 L3MBTL1 (0.39) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18734953 0.86 MGAM (0.32) MGAMGAASIMGAM2
SCHEMBL18735371 0.80 L3MBTL1 (0.35) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18734968 0.79 L3MBTL1 (0.36) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735373 0.78 L3MBTL1 (0.34) L3MBTL1KMT2APOLB
SCHEMBL18735174 0.77 — —

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-2017060400-A1 PROTECTED CARBOXYLIC ACID-BASED METABOLITES FOR THE TREATMENT OF DISESASES RELATED TO MITOCHONDRIAL DYSFUNCTIONS NEUROVIVE PHARMACEUTICAL AB (SE) 2017-04-13 — — WO disclosed
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