SCHEMBL1698906

SCHEMBL1698906

CC(C)=CCC1(C#N)CC1

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
SCHEMBL2439251 0.91 ALDH1A1 (0.33)
SCHEMBL1698964 0.91 TP53 (0.31)
SCHEMBL2437793 0.90 ALDH1A1 (0.37)
SCHEMBL1698923 0.83
SCHEMBL14322496 0.78 ALOX15 (0.32)
SCHEMBL14559627 0.78
SCHEMBL17106355 0.78
SCHEMBL17106358 0.78
SCHEMBL1699041 0.75
SCHEMBL14323461 0.71 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362765-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-07 EP claimed
WO-2010065446-A2 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2010-06-10 WO claimed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US claimed
EP-2362765-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2020-04-08 EP disclosed
US-20180258371-A1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2018-09-13 US disclosed
US-9994793-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2018-06-12 US disclosed
EP-3121255-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2018-03-28 EP disclosed
EP-3287511-A1 PERFUME SYSTEMS The Procter & Gamble Company (US) 2018-02-28 EP disclosed
EP-3121255-A1 PERFUME SYSTEMS The Procter and Gamble Company (US) 2017-01-25 EP disclosed
EP-3121256-A1 PERFUME SYSTEMS The Procter and Gamble Company (US) 2017-01-25 EP disclosed
US-20160326458-A1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2016-11-10 US disclosed
EP-2585568-A1 PERFUME SYSTEMS The Procter and Gamble Company (US) 2013-05-01 EP disclosed
US-8431520-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2013-04-30 US disclosed
US-8431520-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2013-04-30 US disclosed
US-20130012422-A1 PERFUME SYSTEMS SMETS JOHAN (BE) 2013-01-10 US disclosed
US-20130012422-A1 PERFUME SYSTEMS SMETS JOHAN (BE) 2013-01-10 US disclosed
WO-2011163325-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2011-12-29 WO disclosed
US-20110308556-A1 PERFUME SYSTEMS PROCTER & GAMBLE COMPANY, THE 2011-12-22 US disclosed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US disclosed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US disclosed