SCHEMBL18993233

SCHEMBL18993233

CC(Cc1ccccc1)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 19/20 0.78
ADRB1 P08588 17/20 0.68

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
SCHEMBL5457160 1.00 ADRB2 (0.78) ADRB2ADRB1
SCHEMBL13805371 0.90 ADRB2 (0.80) ADRB2ADRB1
SCHEMBL13805369 0.90 ADRB2 (0.80) ADRB2ADRB1
SCHEMBL6253549 0.89 ADRB2 (0.66) ADRB2ADRB1
SCHEMBL6253558 0.89 ADRB2 (0.66) ADRB2ADRB1
SCHEMBL14997292 0.89 ADRB2 (0.68) ADRB2ADRB1
Carmoterol SCHEMBL5990417 0.88 ADRB2 (1.00) ADRB2ADRB1
Carmoterol SCHEMBL13619222 0.88 ADRB2 (1.00) ADRB2ADRB1
Carmoterol SCHEMBL10494358 0.88 ADRB2 (1.00) ADRB2ADRB1
Carmoterol SCHEMBL11912044 0.88 ADRB2 (1.00) ADRB2ADRB1

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-9682957-B2 Diamide compounds having muscarinic receptor antagonist and β2 adrenergic receptor agonist activity THERAVANCE RESPIRATORY COMPANY, LLC (US) 2017-06-20 US disclosed