SCHEMBL6668233

SCHEMBL6668233

CCCCCCCCCCCC(=O)O[C@@H]1/C(=N\OCc2ccccc2)CO[C@H](CO)[C@H]1O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.42
▸ PRKCA P17252 5/20 0.42
▸ HPSE Q9Y251 1/20 0.41
▸ CDC25B P30305 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ CYP2C19 P33261 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ TK2 O00142 2/20 0.36

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
SCHEMBL6667562 0.81 PRKCA (0.50) PRKCATK2
SCHEMBL6669419 0.81 PTPN1 (0.44) PTPN1HPSECDC25BCYP2C19MAPT
SCHEMBL27938346 0.70 HPSE (0.40) PTPN1PRKCAHPSE
SCHEMBL13207933 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL1818377 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL13207997 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL1821071 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL13207993 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL13207931 0.68 CES2 (0.46) PTPN1HPSEBCHE
SCHEMBL13997512 0.67 CES2 (0.45) PTPN1HPSECDC25BBCHE

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1163248-B1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO (DK) 2004-09-22 — — EP disclosed
US-20020102342-A1 1,5-Anhydro-D-fructose substituted with a hydrophobic group for use as anti-oxidant and/or emulsifier DANISCO A/S (DK) 2002-08-01 — — US disclosed
EP-1163248-A1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO A/S (DK) 2001-12-19 — — EP disclosed
WO-2000056745-A1 1,5-ANHYDRO-D-FRUCTOSE SUBSTITUTED WITH A HYDROPHOBIC GROUP FOR USE AS ANTI-OXIDANT AND/OR EMULSIFIER DANISCO A/S (DK) 2000-09-28 — — WO disclosed
Send feedback