SCHEMBL20684361

SCHEMBL20684361

O=C(NCc1ccc(-c2cccc(C(O)(C(=O)OCC3CCN(Cc4ccccc4)CC3)c3ccccc3)c2)s1)c1ccc(CNCC(O)c2ccc(O)c3[nH]c(=O)ccc23)nc1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.87
▸ CHRM3 P20309 20/20 0.87

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
SCHEMBL19782249 1.00 ADRB2 (0.87) ADRB2CHRM3
SCHEMBL19782488 0.93 ADRB2 (1.00) ADRB2CHRM3
SCHEMBL20684418 0.93 ADRB2 (1.00) ADRB2CHRM3
SCHEMBL20684419 0.92 ADRB2 (0.92) ADRB2CHRM3
SCHEMBL19782253 0.92 ADRB2 (0.92) ADRB2CHRM3
SCHEMBL19784583 0.91 ADRB2 (0.86) ADRB2CHRM3
SCHEMBL20684375 0.91 ADRB2 (0.86) ADRB2CHRM3
SCHEMBL19782256 0.91 ADRB2 (0.86) ADRB2CHRM3
SCHEMBL19782638 0.91 ADRB2 (0.88) ADRB2CHRM3
SCHEMBL19784579 0.91 ADRB2 (0.88) ADRB2CHRM3

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-3484879-B1 HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2020-12-30 — — EP claimed
US-10196386-B2 Compounds having muscarinic receptor antagonist and beta2 adrenergic receptor agonist activity CHIESI FARMACEUTICI S.P.A. (IT) 2019-02-05 — — US claimed

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-10196386-B2 Compounds having muscarinic receptor antagonist and beta2 adrenergic receptor agonist activity ADRB2, ADRB1, ADRA2B ADRB2 1/4885CHRM3 13/4885

“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.

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