SCHEMBL5204459

SCHEMBL5204459

CC(C)c1ccc(S(=O)(=O)Nc2ccc(N3CCCCC3NC[C@H](O)COc3ccc(O)c(NS(C)(=O)=O)c3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.47
ADRB1 P08588 12/20 0.43
ADRB2 P07550 10/20 0.43

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
SCHEMBL5206629 0.92 ADRB3 (0.47) ADRB3ADRB1ADRB2
SCHEMBL5206957 0.80 ADRB3 (0.51) ADRB3ADRB1ADRB2
SCHEMBL5203231 0.79 ADRB3 (0.51) ADRB3ADRB1ADRB2
SCHEMBL7246049 0.77 ADRB3 (0.54) ADRB3ADRB1ADRB2
SCHEMBL6074507 0.76 ADRB3 (0.64) ADRB3ADRB1ADRB2
SCHEMBL6074795 0.75 ADRB3 (0.56) ADRB3ADRB1ADRB2
SCHEMBL11670249 0.74 ADRB3 (0.60) ADRB3ADRB1ADRB2
SCHEMBL6074614 0.73 ADRB3 (0.60) ADRB3ADRB1ADRB2
SCHEMBL7640888 0.73 ADRB3 (0.60) ADRB3ADRB1ADRB2
SCHEMBL7166129 0.70 ADRB3 (0.60) ADRB3ADRB1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242083-B1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI AVENTIS (FR) 2007-03-14 EP claimed
EP-1242083-B1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI AVENTIS (FR) 2007-03-14 EP disclosed
US-6867220-B2 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containing them SANOFI-SYNTHELABO (FR) 2005-03-15 US disclosed
US-20030040530-A1 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containning them SANOFI-AVENTIS (FR) 2003-02-27 US disclosed
EP-1242083-A1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Sanofi-Aventis (FR) 2002-09-25 EP disclosed
WO-2001043744-A1 PHENOXYPROPANOLAMINES, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2001-06-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030040530-A1 Phenoxypropanolamines, method for producing them and pharmaceutical compositions containning them CNR1, CORO1C, CBR1 ADRB3 8/4885ADRB1 16/4885ADRB2 18/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.