SCHEMBL14764723

SCHEMBL14764723

CC(C)Oc1nc2cc(OC(C)(C)C)cc(C3CO3)c2s1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL14764721 1.00
SCHEMBL27697097 0.76 ELANE (0.32)
SCHEMBL1908581 0.75 NPC1 (0.35)
SCHEMBL616550 0.75
SCHEMBL614538 0.75
SCHEMBL3835371 0.74 ACACB (0.32)
SCHEMBL13977164 0.74 ACACB (0.32)
SCHEMBL27958479 0.74 PTGS1 (0.34)
SCHEMBL616683 0.72 PTGS1 (0.30)
SCHEMBL14771565 0.72 PTGS1 (0.30)

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106187942-B Benzothiazolone compounds 诺华股份有限公司 2020-06-26 CN disclosed
US-10251868-B2 Benzothiazolone compound NOVARTIS AG (CH) 2019-04-09 US disclosed
US-20180140582-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2018-05-24 US disclosed
US-9913828-B2 Benzothiazolone compound NOVARTIS AG (CH) 2018-03-13 US disclosed
EP-3243817-A1 SALTS OF BENZOTHIAZOLONE COMPOUND AS BETA-2-ADRENOCEPTOR AGONIST Novartis AG (CH) 2017-11-15 EP disclosed
EP-2890687-B1 SALTS OF BENZOTHIAZOLONE COMPOUND AS BETA-2-ADRENOCEPTOR AGONIST NOVARTIS AG (CH) 2017-06-28 EP disclosed
EP-2961391-B1 FORMULATION COMPRISING BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2017-05-17 EP disclosed
US-9623012-B2 Formulation comprising benzothiazolone compound NOVARTIS AG (CH) 2017-04-18 US disclosed
CN-106187942-A Benzothiazolone compounds 诺华股份有限公司 2016-12-07 CN disclosed
CN-106146428-A Salt as the benzothiazolone compound of β 2 adrenoreceptor agonists 诺华股份有限公司 2016-11-23 CN disclosed
CN-103781771-B Benzothiazolone compounds 诺华股份有限公司 2016-08-24 CN disclosed
US-20160075670-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2016-03-17 US disclosed
US-20160000761-A1 Formulation comprising benzothiazolone compound NOVARTIS AG (CH) 2016-01-07 US disclosed
US-20150336914-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2015-11-26 US disclosed
EP-2890687-A1 SALTS OF BENZOTHIAZOLONE COMPOUND AS BETA-2-ADRENOCEPTOR AGONIST Novartis AG (CH) 2015-07-08 EP disclosed
US-20150094346-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2015-04-02 US disclosed
US-8933108-B2 Benzothiazolone compound NOVARTIS AG (CH) 2015-01-13 US disclosed
WO-2014033654-A1 SALTS OF BENZOTHIAZOLONE COMPOUND AS BETA-2-ADRENOCEPTOR AGONIST NOVARTIS AG (CH) 2014-03-06 WO disclosed
US-20130245080-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2013-09-19 US disclosed
WO-2013035047-A1 BENZOTHIAZOLONE COMPOUND NOVARTIS AG (CH) 2013-03-14 WO disclosed