SCHEMBL4775882

SCHEMBL4775882

CCN(CC)CCN(CCC(COC(N)=O)c1ccc(O)c2[nH]c(=O)sc12)C(=O)CCOCCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 20/20 0.60

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
SCHEMBL4773493 0.89 ADRB2 (0.57) ADRB2
SCHEMBL4771290 0.87 ADRB2 (0.56) ADRB2
SCHEMBL3601528 0.84 ADRB2 (0.62) ADRB2
SCHEMBL3583833 0.81 ADRB2 (0.68) ADRB2
SCHEMBL3586438 0.80 ADRB2 (0.83) ADRB2
Bromide SCHEMBL3589861 0.80 ADRB2 (0.82) ADRB2
SCHEMBL4775886 0.79 ADRB2 (0.69) ADRB2
SCHEMBL3611658 0.78 ADRB2 (0.66) ADRB2
SCHEMBL3623194 0.77 ADRB2 (0.66) ADRB2
SCHEMBL4218384 0.75 ADRB2 (1.00) ADRB2

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-1915354-A1 NOVEL BENZOTHIAZOLONE DERIVATIVES AstraZeneca AB (SE) 2008-04-30 EP disclosed
WO-2007018461-A1 NOVEL BENZOTHIAZOLONE DERIVATIVES ASTRAZENECA AB (SE) 2007-02-15 WO disclosed