SCHEMBL4437575

SCHEMBL4437575

NC1=N[C@H](CCOCc2ccccc2)CO1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 6/20 0.78

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
SCHEMBL1837809 1.00 TAAR1 (0.78) TAAR1
SCHEMBL1837806 1.00 TAAR1 (0.78) TAAR1
SCHEMBL3616189 0.88 TAAR1 (1.00) TAAR1
SCHEMBL3616186 0.88 TAAR1 (1.00) TAAR1
SCHEMBL1833346 0.81 TAAR1 (0.75) TAAR1
SCHEMBL1833340 0.81 TAAR1 (0.75) TAAR1
SCHEMBL3617280 0.81 TAAR1 (1.00) TAAR1
SCHEMBL3617283 0.81 TAAR1 (1.00) TAAR1
SCHEMBL3617830 0.81 TAAR1 (1.00) TAAR1
SCHEMBL3612359 0.79 TAAR1 (1.00) 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-2114906-A1 NOVEL 2-AMINOOXAZOLINES AS TAAR1 LIGANDS FOR CNS DISORDERS F. Hoffmann-Roche AG (CH) 2009-11-11 EP disclosed
WO-2008092785-A1 NOVEL 2-AMINOOXAZOLINES AS TAAR1 LIGANDS FOR CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2008-08-07 WO disclosed