SCHEMBL23223725

SCHEMBL23223725

O=C(OC1CN2CCC1CC2)C1(NCc2cccc(OCc3cccc(OCCCCNC[C@H](O)c4ccc(O)c5[nH]c(=O)ccc45)c3)c2)CCc2ccccc21

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.76
▸ CHRM3 P20309 19/20 0.76

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
SCHEMBL18918578 1.00 ADRB2 (0.76) ADRB2CHRM3
SCHEMBL23198069 1.00 ADRB2 (0.76) ADRB2CHRM3
SCHEMBL18918577 1.00 ADRB2 (0.76) ADRB2CHRM3
SCHEMBL18946395 0.98 ADRB2 (0.73) ADRB2CHRM3
SCHEMBL18918497 0.98 ADRB2 (0.78) ADRB2CHRM3
SCHEMBL23198097 0.98 ADRB2 (0.78) ADRB2CHRM3
SCHEMBL18918499 0.98 ADRB2 (0.78) ADRB2CHRM3
SCHEMBL18946393 0.92 ADRB2 (0.74) ADRB2CHRM3
SCHEMBL18918506 0.92 ADRB2 (0.74) ADRB2CHRM3
SCHEMBL18918503 0.92 ADRB2 (0.74) 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-3383867-B1 COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY CHIESI FARM SPA (IT) 2021-04-14 — — EP disclosed
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