SCHEMBL8513204

SCHEMBL8513204

CCCC[C@H]1CCC[CH][C@H]1O[C@@H]1O[C@H](C)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR1 P30872 1/20 0.35
SSTR2 P30874 1/20 0.35
SSTR4 P31391 1/20 0.35
SSTR3 P32745 1/20 0.35
SSTR5 P35346 1/20 0.35
FGF1 P05230 3/20 0.31
FGF2 P09038 3/20 0.31
VEGFA P15692 3/20 0.31
HPSE Q9Y251 3/20 0.31
SELP P16109 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
BCHE P06276 1/20 0.30
PTPN1 P18031 1/20 0.30
CDC25B P30305 1/20 0.30
GJB2 P29033 1/20 0.30

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
SCHEMBL8513448 0.90 SSTR1 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL8513450 0.90 SSTR1 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL8513989 0.84 PTPN1 (0.36) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL8513985 0.84 PTPN1 (0.36) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL2013392 0.82 SSTR1 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL2013391 0.82 SSTR1 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL14932066 0.82 SSTR1 (0.37) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL14932065 0.82 SSTR1 (0.37) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL2014901 0.73 SLC6A2 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL2014900 0.73 SLC6A2 (0.35) SSTR1SSTR2SSTR4SSTR3SSTR5

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
EP-2457573-A1 Methods of use of glycomimetics with replacements for hexoses and N-Acetyl hexosamines GlycoMimetics, Inc. (US) 2012-05-30 EP disclosed