SCHEMBL8779233

SCHEMBL8779233

C[C@@H]1O[C@@H](O[C@H]2CCCC[C@H]2O)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.42
SSTR1 P30872 1/20 0.38
SSTR2 P30874 1/20 0.38
SSTR4 P31391 1/20 0.38
SSTR3 P32745 1/20 0.38
SSTR5 P35346 1/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
BCHE P06276 2/20 0.37
PDPK1 O15530 1/20 0.36
MTOR P42345 1/20 0.36
PDE4D Q08499 1/20 0.35
SLC18A3 Q16572 2/20 0.35
PTPN1 P18031 2/20 0.35
PTPN2 P17706 1/20 0.35
PTPN11 Q06124 1/20 0.35

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
SCHEMBL17148796 0.85 SLC6A2 (0.37) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2287910 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2287912 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2292205 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL12380734 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2292198 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL12380733 0.83 PTPN1 (0.51) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2012813 0.83 BCHE (0.40) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2012812 0.83 BCHE (0.40) SLC6A2SSTR1SSTR2SSTR4SSTR3
SCHEMBL2013222 0.83 SLC6A2 (0.38) SLC6A2SSTR1SSTR2SSTR4SSTR3

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-0787739-A1 Anti-adhesive piperidine and pyrollidine -carboxylic acids HOECHST AKTIENGESELLSCHAFT (DE) 1997-08-06 EP disclosed