SCHEMBL6514134

SCHEMBL6514134

CC(C)(Cc1cccc(CC(=O)N2CCC[C@H]2C(N)=O)c1)NCC(O)c1ccc(O)cc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 16/20 0.46
DPP4 P27487 1/20 0.44
CASR P41180 1/20 0.40
ADRB1 P08588 1/20 0.40

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
SCHEMBL3924994 0.93 ADRB2 (0.44) ADRB2DPP4CASR
SCHEMBL6506911 0.88 ADRB2 (0.52) ADRB2ADRB1
SCHEMBL6506907 0.88 ADRB2 (0.52) ADRB2ADRB1
SCHEMBL6484386 0.82 LMNA (0.45) ADRB2DPP4CASRADRB1
SCHEMBL6528628 0.82 ADRB2 (0.46) ADRB2CASRADRB1
SCHEMBL6529084 0.82 ADRB2 (0.51) ADRB2ADRB1
SCHEMBL6508454 0.81 ADRB2 (0.47) ADRB2CASRADRB1
SCHEMBL6508632 0.80 ADRB2 (0.49) ADRB2ADRB1
SCHEMBL6533340 0.80 ADRB2 (0.49) ADRB2ADRB1
SCHEMBL6509325 0.79 ADRB2 (0.48) 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
WO-2005092841-A1 COMPOUNDS HAVING BETA-AGONIST ACTIVITY PFIZER LIMITED (GB) 2005-10-06 WO disclosed