SCHEMBL7569649

SCHEMBL7569649

CC(C)(C)[Si](Oc1ccc(OC[C@@H](O)CNCCc2ccc(NC3CCN(C(=O)c4cc5cccc([N+](=O)[O-])c5[nH]4)CC3)cc2)cc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.48
ADRB1 P08588 16/20 0.48
ADRB2 P07550 4/20 0.45
HRH4 Q9H3N8 1/20 0.41

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
SCHEMBL7626550 0.98 ADRB3 (0.52) ADRB3ADRB1ADRB2
SCHEMBL7571777 0.89 ADRB3 (0.53) ADRB3ADRB1ADRB2
SCHEMBL7097005 0.88 ADRB3 (0.62) ADRB3ADRB1ADRB2HRH4
SCHEMBL7569026 0.85 ADRB3 (0.51) ADRB3ADRB1ADRB2
SCHEMBL7094914 0.85 ADRB3 (0.50) ADRB3ADRB1ADRB2
SCHEMBL7621702 0.83 ADRB3 (0.55) ADRB3ADRB1ADRB2
SCHEMBL7094525 0.81 ADRB3 (0.71) ADRB3ADRB1ADRB2
SCHEMBL7600554 0.81 ADRB3 (0.71) ADRB3ADRB1ADRB2
SCHEMBL7094990 0.81 ADRB3 (0.63) ADRB3ADRB1ADRB2
SCHEMBL7094254 0.81 ADRB3 (0.73) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6451814-B1 SUBSTITUTED 4-((4-AMINO-5-HYDROXYPHENYL)-OXY-)PIPERIDINE ANALOGS; METABOLIC DISORDERS; ANTIDIABETIC AGENTS; ATHERO-SCLEROSIS, GASTROINTESTINAL DISORDERS, GLAUCOMA, NEUROGENETIC INFLAMMATION, OCULAR HYPERTENSION AND FREQUENT URINATION WYETH 2002-09-17 US disclosed
US-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-07 US disclosed
WO-2002006229-A2 HETEROCYCLIC BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 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-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 ADRB3 2/4885ADRB1 1/4885ADRB2 3/4885

“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.