SCHEMBL5204833

SCHEMBL5204833

CC(C)c1ccc(S(=O)(=O)Nc2ccc(N3CCC(NCC(O)COc4ccc(O)cc4)CC3)nc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 18/20 0.54
ADRB3 P13945 18/20 0.54
ADRB2 P07550 17/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.44

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
SCHEMBL5207745 0.92 ADRB1 (0.46) ADRB1ADRB3ADRB2KDM4EGAA
SCHEMBL5206957 0.88 ADRB3 (0.51) ADRB1ADRB3ADRB2KDM4EGAA
SCHEMBL5203201 0.88 ADRB3 (0.42) ADRB1ADRB3ADRB2KDM4EGAA
SCHEMBL5203113 0.83 ADRB1 (0.40) ADRB1ADRB3ADRB2KDM4EGAA
SCHEMBL5206634 0.80 CYP3A4 (0.44) ADRB1ADRB3ADRB2KDM4EGAA
SCHEMBL6953116 0.79 ADRB1 (0.56) ADRB1ADRB3ADRB2KMT2A
SCHEMBL7473303 0.79 ADRB3 (0.58) ADRB1ADRB3ADRB2
SCHEMBL6073654 0.78 ADRB1 (0.62) ADRB1ADRB3ADRB2KMT2A
SCHEMBL6801052 0.77 ADRB3 (0.59) ADRB1ADRB3ADRB2
SCHEMBL7469736 0.77 ADRB3 (0.53) ADRB1ADRB3ADRB2

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 ADRB1 16/4885ADRB3 8/4885ADRB2 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.