SCHEMBL6528102

SCHEMBL6528102

CC(C)(Cc1cccc(CC(=O)NCc2ccc(Cl)cc2)c1)NCC(O)c1ccc(O)cc1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 20/20 0.68
CHRM3 P20309 2/20 0.47
ADRB1 P08588 1/20 0.44

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
SCHEMBL13840714 0.93 ADRB2 (0.65) ADRB2CHRM3ADRB1
SCHEMBL3914436 0.93 ADRB2 (0.65) ADRB2CHRM3ADRB1
SCHEMBL6506204 0.92 ADRB2 (0.78) ADRB2CHRM3ADRB1
SCHEMBL6511118 0.91 ADRB2 (0.68) ADRB2CHRM3ADRB1
SCHEMBL4384722 0.88 ADRB2 (0.87) ADRB2CHRM3ADRB1
SCHEMBL4384727 0.88 ADRB2 (0.87) ADRB2CHRM3ADRB1
SCHEMBL13846486 0.88 ADRB2 (0.59) ADRB2CHRM3ADRB1
SCHEMBL6507743 0.87 ADRB2 (0.65) ADRB2CHRM3ADRB1
SCHEMBL5034540 0.85 ADRB2 (0.88) ADRB2CHRM3
SCHEMBL5034534 0.85 ADRB2 (0.88) 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
WO-2005092841-A1 COMPOUNDS HAVING BETA-AGONIST ACTIVITY PFIZER LIMITED (GB) 2005-10-06 WO disclosed