SCHEMBL18735377

SCHEMBL18735377

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

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ SI P14410 1/20 0.38
▸ MGAM2 Q2M2H8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ METAP2 P50579 9/20 0.34
▸ METAP1 P53582 6/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL18735331 0.93 METAP2 (0.33) L3MBTL1KMT2APOLBMETAP2METAP1
SCHEMBL18735375 0.91 METAP2 (0.32) L3MBTL1KMT2APOLBMETAP2METAP1
SCHEMBL18735343 0.86 L3MBTL1 (0.39) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18734958 0.86 MGAM (0.33) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735051 0.86 MGAM (0.40) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735378 0.83 METAP2 (0.32) L3MBTL1KMT2APOLBMETAP2METAP1
SCHEMBL18735351 0.81 METAP2 (0.31) L3MBTL1METAP2METAP1
SCHEMBL18735371 0.80 L3MBTL1 (0.35) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735059 0.79 KMT2A (0.33) MGAMGAASIMGAM2L3MBTL1
SCHEMBL18735334 0.78 METAP2 (0.34) METAP2METAP1

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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