SCHEMBL1834776

SCHEMBL1834776

NC1=N[C@@H](CCCCOc2cc(O)cc(O)c2)CO1

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.56

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
SCHEMBL574560 0.88 TAAR1 (0.59) TAAR1
SCHEMBL1834781 0.80 TAAR1 (0.70) TAAR1
SCHEMBL1834787 0.80 TAAR1 (0.70) TAAR1
SCHEMBL1831897 0.74 TAAR1 (0.67) TAAR1
SCHEMBL1831899 0.74 TAAR1 (0.67) TAAR1
SCHEMBL1833663 0.72 TAAR1 (1.00) TAAR1
SCHEMBL1833658 0.72 TAAR1 (1.00) TAAR1
SCHEMBL1834773 0.71
SCHEMBL1962164 0.71
SCHEMBL1726234 0.71 TAAR1 (0.57) TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2321287-A1 4,5-DIHYDRO-OXAZOL-2-YL DERIVATIVES F. Hoffmann-La Roche AG (CH) 2011-05-18 EP disclosed
WO-2010010014-A1 4,5-DIHYDRO-OXAZOL-2-YL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-01-28 WO disclosed