SCHEMBL8831084

SCHEMBL8831084

CCO[C@@H]1O[C@H](COC(C)=O)[C@@H](O)[C@H](OCc2ccccc2)[C@H]1NC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.57
▸ LMNA P02545 3/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ SSTR5 P35346 6/20 0.48
▸ SSTR3 P32745 5/20 0.48
▸ SSTR2 P30874 3/20 0.48
▸ SSTR1 P30872 1/20 0.48
▸ SSTR4 P31391 1/20 0.48
▸ MCHR1 Q99705 7/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44

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
SCHEMBL8831093 0.91 POLB (0.60) POLBLMNAKMT2AL3MBTL1ALDH1A1
SCHEMBL10526777 0.88 POLB (0.52) POLBLMNAKMT2ASSTR5SSTR3
SCHEMBL6810335 0.87 POLB (0.52) POLBLMNAKMT2ASSTR5SSTR3
SCHEMBL5840827 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL22053387 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL5841004 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL5841003 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL5840823 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL5840925 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1
SCHEMBL16632757 0.86 SSTR5 (0.52) POLBSSTR5SSTR3SSTR2SSTR1

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
US-5646123-A Time dependent administration of oligosaccharide glycosides related to blood group determinants having a type I or type II core structure in reducing inflammation in a sensitized mammal arising form exposure to an antigen ALBERTA RESEARCH COUNCIL (CA) 1997-07-08 — — US disclosed
US-5580858-A Immunosuppressive and tolerogenic modified Lewisx compounds ALBERTA RESEARCH COUNCIL (CA) 1996-12-03 — — US disclosed
WO-1993024505-A1 REDUCING INFLAMMATION BY TIME DEPENDENT ADMINISTRATION OF OLIGOSACCHARIDES GLYCOSIDES RELATED TO BLOOD GROUP DETERMINANTS ALBERTA RESEARCH COUNCIL (CA) 1993-12-09 — — WO disclosed
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