SCHEMBL18557641

SCHEMBL18557641

O=C(OCC1CCN(Cc2ccccc2)CC1)C(c1ccccc1)c1cccc(OCC2CN(C(=O)c3ccc(CNC[C@H](O)c4ccc(O)c5[nH]c(=O)ccc45)cc3)C2)c1

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 20/20 0.79
▸ CHRM3 P20309 18/20 0.79

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
SCHEMBL18557775 0.94 ADRB2 (0.71) ADRB2CHRM3
SCHEMBL18557647 0.92 ADRB2 (0.69) ADRB2CHRM3
SCHEMBL24404429 0.91 ADRB2 (0.69) ADRB2CHRM3
SCHEMBL18557650 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL18557777 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL18557735 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL18812181 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL24404523 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL24404451 0.90 ADRB2 (0.66) ADRB2CHRM3
SCHEMBL18813834 0.90 ADRB2 (0.66) 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
US-9579314-B2 Compounds having muscarinic receptor antagonist and BETA2 adrenergic receptor agonist activity CHIESI FARMACEUTICI S.P.A. (IT) 2017-02-28 — — US disclosed
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