SCHEMBL6547703

SCHEMBL6547703

COc1ccc(C(Cc2ccccc2)NCC(O)c2ccc(O)c(NS(C)(=O)=O)c2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 20/20 1.00
ADRB2 P07550 4/20 0.80
ADRB1 P08588 3/20 0.80

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
SCHEMBL6547705 1.00 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL13676582 1.00 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7037452 0.92 ADRB3 (0.85) ADRB3ADRB2ADRB1
SCHEMBL7040917 0.90 ADRB3 (0.82) ADRB3ADRB2ADRB1
SCHEMBL7675887 0.89 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7674992 0.89 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7678634 0.89 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7670221 0.89 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7674986 0.89 ADRB3 (1.00) ADRB3ADRB2ADRB1
SCHEMBL7043995 0.89 ADRB3 (0.80) 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 10 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 claimed
EP-0659737-A2 Catecholamine surrogates useful as B3 agonists BRISTOL-MYERS SQUIBB COMPANY (US) 1995-06-28 EP claimed
JP-7206806-A None JP disclosed
EP-1382333-A2 Use of beta 3 adrenergic receptor agonists in the treatment of dysuria FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-21 EP disclosed
EP-0659737-B1 Catecholamine surrogates useful as beta 3 agonists BRISTOL MYERS SQUIBB CO (US) 2003-03-26 EP disclosed
US-6495546-B1 SUCH AS 1-(N-BENZYL-N-(3-METHOXY-6,7,8,9-TETRAHYDRO-5H-BENZO-CYCLOHEPTEN-6-YL)AMINO)-3-PHENOXY-2-PROPANOL; ADRENERGIC RECEPTOR AGONISTS; ANTIULCEROUS, LIPOLYTIC, ANTIURINARY INCONTINENCE AND ANTIPOLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-17 US disclosed
EP-1070046-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-24 EP disclosed
WO-1999051564-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-14 WO disclosed
JP-H07206806-A CATECHOLAMINE SURROGATE USEFUL AS BETA3-AGONIST BRISTOL MYERS SQUIBB CO 1995-08-08 JP disclosed
EP-0659737-A2 Catecholamine surrogates useful as B3 agonists BRISTOL-MYERS SQUIBB COMPANY (US) 1995-06-28 EP disclosed