SCHEMBL7041459

SCHEMBL7041459

CC[Si](CC)(CC)OC(CNC(Cc1ccc(F)cc1)c1ccc(OCc2ccccc2)cc1)c1ccc(OCc2ccccc2)c(NS(C)(=O)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ADRB3 P13945 20/20 0.56
▸ ADRB2 P07550 6/20 0.45
▸ ADRB1 P08588 4/20 0.45

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
SCHEMBL7041464 1.00 ADRB3 (0.56) ADRB3ADRB2ADRB1
SCHEMBL7035908 1.00 ADRB3 (0.56) ADRB3ADRB2ADRB1
SCHEMBL7044277 0.95 ADRB3 (0.52) ADRB3ADRB2ADRB1
SCHEMBL7044256 0.95 ADRB3 (0.52) ADRB3ADRB2ADRB1
SCHEMBL7044253 0.95 ADRB3 (0.52) ADRB3ADRB2ADRB1
SCHEMBL7040250 0.95 ADRB3 (0.52) ADRB3ADRB2ADRB1
SCHEMBL7040219 0.95 ADRB3 (0.61) ADRB3ADRB2ADRB1
SCHEMBL7040215 0.95 ADRB3 (0.61) ADRB3ADRB2ADRB1
SCHEMBL7042132 0.94 ADRB3 (0.54) ADRB3ADRB2ADRB1
SCHEMBL7040810 0.93 ADRB3 (0.57) ADRB3ADRB2ADRB1

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
EP-0659737-B1 Catecholamine surrogates useful as beta 3 agonists BRISTOL MYERS SQUIBB CO (US) 2003-03-26 — — EP disclosed
EP-0659737-A2 Catecholamine surrogates useful as B3 agonists BRISTOL-MYERS SQUIBB COMPANY (US) 1995-06-28 — — EP disclosed
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