SCHEMBL9522694

SCHEMBL9522694

C=CCOC1C(O)OC2C(O)COC21

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL24089791 0.84 THRB (0.35) THRBLMNAALDH1A1
Isosorbide SCHEMBL618288 0.77 THRB (0.54) THRBLMNAALDH1A1
SCHEMBL2051333 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2052124 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL8588966 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL618289 0.75 THRB (0.46) THRBLMNAALDH1A1
SCHEMBL22371893 0.75 THRB (0.46) THRBLMNAALDH1A1
SCHEMBL17864238 0.75 THRB (0.46) THRBLMNAALDH1A1
SCHEMBL9524037 0.72 THRB (0.46) THRBLMNA
SCHEMBL24089892 0.71

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-0323994-B1 PROCESS FOR PREPARING ANHYDRIDES OF HEXITOLS, HEXONOLACTONES, HEXOSES AND HEXOSIDES ERIDANIA BEGHIN-SAY (FR) 1993-03-31 EP claimed
EP-0323994-B1 PROCESS FOR PREPARING ANHYDRIDES OF HEXITOLS, HEXONOLACTONES, HEXOSES AND HEXOSIDES ERIDANIA BEGHIN-SAY (FR) 1993-03-31 EP disclosed
EP-0323994-A1 PROCESS FOR PREPARING ANHYDRIDES OF HEXITOLS, HEXONOLACTONES, HEXOSES AND HEXOSIDES ERIDANIA BEGHIN-SAY (FR) 1989-07-19 EP disclosed
WO-1989000162-A1 PROCESS FOR PREPARING ANHYDRIDES OF HEXITOLS, HEXONOLACTONES, HEXOSES AND HEXOSIDES BEGHIN-SAY, S.A. (FR) 1989-01-12 WO disclosed