SCHEMBL20101555

SCHEMBL20101555

COP(=O)(OC)OC[C@@H]1C[C@@H](O)CO1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
ENPP2 Q13822 1/20 0.31
LPAR2 Q9HBW0 1/20 0.31

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
SCHEMBL21632873 0.82 ALDH1A1 (0.41) ALDH1A1ENPP2LPAR2
SCHEMBL23470285 0.81 FBP1 (0.44) ALDH1A1ENPP2LPAR2
SCHEMBL1979763 0.78 ALDH1A1 (0.41) ALDH1A1ENPP2LPAR2
SCHEMBL18541684 0.76
SCHEMBL24497709 0.75 EPHX1 (0.30)
SCHEMBL20169032 0.73
SCHEMBL20101562 0.72 LMNA (0.44) ALDH1A1
SCHEMBL12413467 0.72 TSHR (0.44) ALDH1A1ENPP2LPAR2
SCHEMBL18530075 0.70 FBP1 (0.37)
SCHEMBL12612316 0.69 M6PR (0.32)

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-3052107-B1 ORGANIC COMPOUNDS TO TREAT HEPATITIS B VIRUS NOVARTIS AG (CH) 2018-05-02 EP disclosed