SCHEMBL22677461

SCHEMBL22677461

C=CCCCO[C@@H]1OC(CO[Si](C)(C)C(C)(C)C)[C@@H](O)C(OCc2ccccc2)C1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.41
LGALS9 O00182 2/20 0.37
MCHR1 Q99705 2/20 0.37
SSTR5 P35346 5/20 0.37
SSTR2 P30874 2/20 0.37
SSTR3 P32745 2/20 0.37
CYP2D6 P10635 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
LGALS3 P17931 1/20 0.35
SLC6A2 P23975 1/20 0.35
POLB P06746 1/20 0.34
PTPN1 P18031 1/20 0.34
CDC25B P30305 1/20 0.34
SELP P16109 2/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL16986935 0.83 LGALS9 (0.37) TACR1LGALS9SSTR5CYP2D6PTPN1
SCHEMBL16986936 0.83 LGALS9 (0.37) TACR1LGALS9SSTR5CYP2D6PTPN1
SCHEMBL22677763 0.83 TACR1 (0.44) TACR1SSTR5SSTR2SSTR3PTPN1
SCHEMBL12606177 0.82 CYP2D6 (0.42) TACR1SSTR5SSTR2SSTR3CYP2D6
SCHEMBL22677471 0.79 TACR1 (0.46) TACR1SSTR5SSTR2SSTR3SLC6A2
SCHEMBL13298889 0.79 NT5E (0.46) TACR1SSTR5SSTR2SSTR3PTPN1
SCHEMBL14363518 0.79 NT5E (0.45) TACR1SSTR5SSTR2SSTR3PTPN1
SCHEMBL14598384 0.79 NT5E (0.45) TACR1SSTR5SSTR2SSTR3PTPN1
SCHEMBL14088876 0.79 NT5E (0.45) TACR1SSTR5SSTR2SSTR3PTPN1
SCHEMBL24996978 0.77 SSTR5 (0.47) TACR1SSTR5SSTR2SSTR3LGALS3

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
WO-2020232194-A1 METHODS FOR GLYCOSYLATION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-11-19 WO disclosed