SCHEMBL5203218

SCHEMBL5203218

CS(=O)(=O)Nc1cc(OC[C@@H](O)CNC2CCN(c3ccc(C#N)cc3)CC2)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.62
ADRB1 P08588 10/20 0.55
ADRB2 P07550 11/20 0.54
HRH1 P35367 1/20 0.50
CCR3 P51677 1/20 0.50
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48

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
SCHEMBL3287727 0.87 ADRB3 (0.50) ADRB3ADRB1ADRB2HRH1CCR3
SCHEMBL3287724 0.87 ADRB3 (0.50) ADRB3ADRB1ADRB2HRH1CCR3
SCHEMBL5202975 0.85 ADRB3 (0.61) ADRB3ADRB1ADRB2
SCHEMBL5206263 0.85 ADRB3 (0.60) ADRB3ADRB1ADRB2
SCHEMBL5206849 0.84 ADRB3 (0.61) ADRB3ADRB1ADRB2
SCHEMBL6073810 0.83 ADRB3 (0.59) ADRB3ADRB1ADRB2
SCHEMBL5210082 0.83 ADRB3 (0.61) ADRB3ADRB1ADRB2
SCHEMBL6075000 0.83 ADRB3 (0.60) ADRB3ADRB1ADRB2ADRA2AADRA2B
SCHEMBL6074996 0.83 ADRB3 (0.60) ADRB3ADRB1ADRB2ADRA2AADRA2B
SCHEMBL7640290 0.83 ADRB3 (0.60) ADRB3ADRB1ADRB2ADRA2AADRA2B

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.