SCHEMBL6892339

SCHEMBL6892339

CCS[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR1 P30872 1/20 0.47
SSTR2 P30874 1/20 0.47
SSTR4 P31391 1/20 0.47
SSTR3 P32745 1/20 0.47
SSTR5 P35346 1/20 0.47
HTR1A P08908 1/20 0.47
TACR2 P21452 3/20 0.46
NT5E P21589 1/20 0.43
PTPN1 P18031 8/20 0.43
CDC25B P30305 6/20 0.43
PTPN2 P17706 3/20 0.43
PTPN11 Q06124 3/20 0.43
PTPN6 P29350 2/20 0.42
GJB2 P29033 1/20 0.41
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40

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
SCHEMBL12083220 1.00 SSTR1 (0.47) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL1521538 1.00 SSTR1 (0.47) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL1521205 1.00 SSTR1 (0.47) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL1764142 0.92 SSTR4 (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL4906226 0.92 SSTR4 (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL14672596 0.90 SSTR4 (0.53) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL19272019 0.90 HTR1A (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL4616594 0.89 HTR1A (0.44) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL19276601 0.89 SSTR4 (0.49) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL19276600 0.89 SSTR4 (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0956000-A4 SYNTHESIS OF GLYCOPHOSPHOLIPID AND PEPTIDE-PHOSPHOLIPID CONJUGATES AND USES THEREOF UNIV EMORY (US) 2004-06-09 EP disclosed
EP-0956000-A1 SYNTHESIS OF GLYCOPHOSPHOLIPID AND PEPTIDE-PHOSPHOLIPID CONJUGATES AND USES THEREOF EMORY UNIVERSITY (US) 1999-11-17 EP disclosed
WO-1998016198-A1 SYNTHESIS OF GLYCOPHOSPHOLIPID AND PEPTIDE-PHOSPHOLIPID CONJUGATES AND USES THEREOF EMORY UNIVERSITY (US) 1998-04-23 WO disclosed