SCHEMBL6253549

SCHEMBL6253549

C[C@H](Cc1ccc(CC(=O)NCc2ccccc2)cc1)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 19/20 0.66
CHRM3 P20309 7/20 0.58
ADRB1 P08588 11/20 0.57

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
SCHEMBL6253558 1.00 ADRB2 (0.66) ADRB2CHRM3ADRB1
SCHEMBL6256979 0.93 ADRB2 (0.61) ADRB2CHRM3ADRB1
SCHEMBL6256984 0.93 ADRB2 (0.61) ADRB2CHRM3ADRB1
SCHEMBL6251539 0.92 ADRB2 (0.67) ADRB2CHRM3ADRB1
SCHEMBL6251534 0.92 ADRB2 (0.67) ADRB2CHRM3ADRB1
SCHEMBL6257135 0.90 ADRB2 (0.64) ADRB2CHRM3ADRB1
SCHEMBL6257130 0.90 ADRB2 (0.64) ADRB2CHRM3ADRB1
SCHEMBL18993233 0.89 ADRB2 (0.78) ADRB2ADRB1
SCHEMBL5457160 0.89 ADRB2 (0.78) ADRB2ADRB1
SCHEMBL6254852 0.88 ADRB2 (0.62) ADRB2CHRM3ADRB1

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-1574501-A1 Quinolinone derivatives, pharmaceutical compositions containing them and their use Pfizer Limited (GB) 2005-09-14 EP claimed
EP-1574501-A1 Quinolinone derivatives, pharmaceutical compositions containing them and their use Pfizer Limited (GB) 2005-09-14 EP disclosed