SCHEMBL22829205

SCHEMBL22829205

O=C(c1ccc(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1)N1CC=C(c2cccc([C@](O)(C(=O)O)c3ccccc3)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.60
▸ CHRM3 P20309 18/20 0.56

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
SCHEMBL22829209 1.00 ADRB2 (0.60) ADRB2CHRM3
SCHEMBL22829172 0.95 ADRB2 (0.59) ADRB2CHRM3
SCHEMBL22829173 0.95 ADRB2 (0.59) ADRB2CHRM3
SCHEMBL22829185 0.94 ADRB2 (0.58) ADRB2CHRM3
SCHEMBL22829187 0.94 ADRB2 (0.58) ADRB2CHRM3
SCHEMBL22829171 0.94 ADRB2 (0.61) ADRB2CHRM3
SCHEMBL22829169 0.94 ADRB2 (0.61) ADRB2CHRM3
SCHEMBL22829132 0.91 ADRB2 (0.63) ADRB2CHRM3
SCHEMBL22829136 0.91 ADRB2 (0.63) ADRB2CHRM3
SCHEMBL22829134 0.90 ADRB2 (0.58) 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 1 patent. 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
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