SCHEMBL6254124

SCHEMBL6254124

C[C@H](Cc1ccc(CC(=O)O)cc1)NC[C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(OCc2ccccc2)c2[nH]c(=O)ccc12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 17/20 0.41
ADRB1 P08588 11/20 0.35
DRD2 P14416 2/20 0.34
DRD1 P21728 2/20 0.34
DRD4 P21917 2/20 0.34
DRD3 P35462 2/20 0.34
BRD4 O60885 1/20 0.34
ADRB3 P13945 1/20 0.34

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
SCHEMBL6254119 1.00 ADRB2 (0.41) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL6257023 0.94 ADRB2 (0.38) ADRB2ADRB1BRD4ADRB3
SCHEMBL694574 0.94 ADRB2 (0.38) ADRB2ADRB1BRD4ADRB3
SCHEMBL6257028 0.94 ADRB2 (0.38) ADRB2ADRB1BRD4ADRB3
SCHEMBL729897 0.94 ADRB2 (0.38) ADRB2ADRB1BRD4ADRB3
SCHEMBL729898 0.94 ADRB2 (0.38) ADRB2ADRB1BRD4ADRB3
SCHEMBL730381 0.88 ADRB2 (0.38) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL704784 0.88 ADRB2 (0.38) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL730380 0.88 ADRB2 (0.38) ADRB2ADRB1DRD2DRD1DRD4
SCHEMBL2142809 0.88 ADRB3 (0.39) ADRB2ADRB1DRD2DRD1DRD4

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