SCHEMBL5167211

SCHEMBL5167211

NC(C(=O)O)C(O)CCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.52
SLCO1B1 Q9Y6L6 1/20 0.52
SLC7A5 Q01650 1/20 0.40
OR51E2 Q9H255 1/20 0.36
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRB2 P47870 2/20 0.36
GABRA4 P48169 2/20 0.36
GABRE P78334 2/20 0.36
GABRA6 Q16445 2/20 0.36
GABRG1 Q8N1C3 2/20 0.36
GABRG3 Q99928 2/20 0.36
GABRQ Q9UN88 2/20 0.36

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
SCHEMBL8746986 0.86 USP2 (0.48) USP2SLCO1B1SLC7A5OR51E2SLC1A3
SCHEMBL211338 0.82 USP2 (0.45) USP2SLCO1B1SLC7A5GSRCYP1A2
SCHEMBL211967 0.82 USP2 (0.45) USP2SLCO1B1SLC7A5GSRCYP1A2
SCHEMBL16731994 0.80 USP2 (0.46) USP2SLCO1B1SLC7A5SLC1A3SLC1A2
SCHEMBL2482515 0.80 USP2 (0.46) USP2SLCO1B1SLC7A5SLC1A3SLC1A2
SCHEMBL16731992 0.80 USP2 (0.46) USP2SLCO1B1SLC7A5SLC1A3SLC1A2
SCHEMBL2482513 0.80 USP2 (0.46) USP2SLCO1B1SLC7A5SLC1A3SLC1A2
SCHEMBL2482516 0.80 USP2 (0.46) USP2SLCO1B1SLC7A5SLC1A3SLC1A2
SCHEMBL131909 0.79
SCHEMBL131910 0.79

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1768994-A2 CYCLIC PEPTIDE ANTIBIOTICS Hagelin, Gunnar (NO) 2007-04-04 EP claimed
WO-2005115097-A2 CYCLIC PEPTIDE ANTIBIOTICS HAGELIN GUNNAR (NO) 2005-12-08 WO claimed
EP-1768994-A2 CYCLIC PEPTIDE ANTIBIOTICS Hagelin, Gunnar (NO) 2007-04-04 EP disclosed
WO-2005115097-A2 CYCLIC PEPTIDE ANTIBIOTICS HAGELIN GUNNAR (NO) 2005-12-08 WO disclosed
EP-0725636-A1 HYDROXYL IONS AS UNIQUE THERAPEUTIC AGENTS AND COMPOUNDS THAT MODULATE THESE IONS, COMPOSITIONS EMPLOYING THESE AGENTS, THERAPEUTIC METHODS FOR USING SUCH AGENTS AND PROCESSES FOR PREPARING THEM FHJ SCIENTIFIC, INC. (US) 1996-08-14 EP disclosed
WO-1995010272-A1 HYDROXYL IONS AS UNIQUE THERAPEUTIC AGENTS AND COMPOUNDS THAT MODULATE THESE IONS, COMPOSITIONS EMPLOYING THESE AGENTS, THERAPEUTIC METHODS FOR USING SUCH AGENTS AND PROCESSES FOR PREPARING THEM FHJ SCIENTIFIC, INC. (US) 1995-04-20 WO disclosed