SCHEMBL14229883

SCHEMBL14229883

C[C@H](Cc1cccc(CC(=O)NC2Cc3ccccc3C2)c1)NC[C@H](O)c1ccc(OCc2ccccc2)c(NS(C)(=O)=O)c1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 11/20 0.59
ADRB3 P13945 10/20 0.47
ADRB1 P08588 1/20 0.42

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
SCHEMBL5038794 0.88 ADRB2 (0.74) ADRB2ADRB3
SCHEMBL5038797 0.88 ADRB2 (0.74) ADRB2ADRB3
SCHEMBL14230277 0.87 ADRB2 (0.78) ADRB2ADRB3
SCHEMBL5041942 0.87 ADRB2 (0.45) ADRB2ADRB3
SCHEMBL5041951 0.87 ADRB2 (0.45) ADRB2ADRB3
SCHEMBL14452354 0.86 ADRB2 (0.45) ADRB2ADRB3
SCHEMBL14230029 0.86 ADRB2 (0.78) ADRB2ADRB3
SCHEMBL14230507 0.83 ADRB2 (0.81) ADRB2ADRB3
SCHEMBL10657723 0.80 ADRB3 (0.63) ADRB2ADRB3
SCHEMBL3917018 0.79 ADRB2 (0.59) ADRB2ADRB3ADRB1

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-7351742-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC. (US) 2008-04-01 US disclosed