SCHEMBL4819261

SCHEMBL4819261

Cc1cc(OCCNC[C@@H](O)c2ccc(O)c(NS(C)(=O)=O)c2)ccc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ADRB3 P13945 20/20 0.56
▸ ADRB1 P08588 3/20 0.50

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
SCHEMBL4819239 1.00 ADRB3 (0.56) ADRB3ADRB1
SCHEMBL4814525 0.95 ADRB3 (0.58) ADRB3ADRB1
SCHEMBL4814538 0.95 ADRB3 (0.58) ADRB3ADRB1
SCHEMBL4819098 0.91 ADRB3 (0.55) ADRB3ADRB1
SCHEMBL4819109 0.91 ADRB3 (0.55) ADRB3ADRB1
SCHEMBL4814068 0.90 ADRB3 (0.64) ADRB3ADRB1
SCHEMBL4814050 0.90 ADRB3 (0.64) ADRB3ADRB1
SCHEMBL4815287 0.90 ADRB3 (0.59) ADRB3ADRB1
SCHEMBL4815558 0.90 ADRB3 (0.55) ADRB3ADRB1
SCHEMBL4815553 0.90 ADRB3 (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7417169-B2 Amino alcohol derivatives, medicinal composition containing the same, and use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-08-26 — — US disclosed
EP-1679304-A1 AMINO ALCOHOL DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USE OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2006-07-12 — — EP disclosed
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