SCHEMBL5366554

SCHEMBL5366554

CCCN(CCC(=O)O)C(=O)c1cc(OC)c2oc(NCc3cccc(Cl)c3)nc2c1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 20/20 0.73

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
SCHEMBL8225336 0.93 THRB (0.70) THRB
SCHEMBL5362964 0.93 THRB (0.70) THRB
SCHEMBL8225411 0.92 THRB (0.69) THRB
SCHEMBL5372755 0.91 THRB (0.68) THRB
SCHEMBL5372654 0.84 THRB (0.75) THRB
SCHEMBL5364323 0.84 THRB (1.00) THRB
SCHEMBL8228510 0.84 THRB (0.60) THRB
SCHEMBL8225403 0.83 THRB (0.73) THRB
SCHEMBL5369542 0.83 THRB (0.75) THRB
SCHEMBL5372748 0.82 THRB (0.58) THRB

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
WO-2007140982-A1 SUBSTITUTED BENZOXAZOLES BAYER HEALTHCARE AG (DE) 2007-12-13 WO disclosed
WO-2007140982-A1 SUBSTITUTED BENZOXAZOLES BAYER HEALTHCARE AG (DE) 2007-12-13 WO disclosed