SCHEMBL6678770

SCHEMBL6678770

O=C(O)c1ccc(S(=O)(=O)c2ccc(CCNC(Cc3ccccc3)[C@H](O)c3cccc(Cl)c3)cc2)cc1O

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 15/20 0.43
ADRB1 P08588 12/20 0.43
HAT1 O14929 4/20 0.41
EP300 Q09472 4/20 0.41

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
SCHEMBL6679282 0.88 SLC2A1 (0.39) ADRB3ADRB1HAT1EP300
SCHEMBL6679483 0.88 SLC2A1 (0.39) ADRB3ADRB1HAT1EP300
SCHEMBL6681905 0.87 TUBB (0.41) ADRB3ADRB1HAT1EP300
SCHEMBL6272839 0.86 KMT2A (0.42) ADRB3ADRB1
SCHEMBL6680789 0.85 ADRB3 (0.45) ADRB3ADRB1
SCHEMBL6687818 0.85 ADRB3 (0.39) ADRB3ADRB1HAT1EP300
SCHEMBL6675743 0.85 ADRB3 (0.43) ADRB3ADRB1
SCHEMBL6679246 0.85 ADORA1 (0.40) ADRB3ADRB1HAT1EP300
SCHEMBL6676287 0.83 ADRB3 (0.55) ADRB3ADRB1
SCHEMBL6676613 0.82 SIGMAR1 (0.39) ADRB3ADRB1

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-2004045610-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2004-06-03 WO disclosed