SCHEMBL886972

SCHEMBL886972

C[C]1CCCC(C2CCCCC2)C1(C)C1CCCCC1

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
SCHEMBL21292008 0.69 HSD11B1 (0.32)
SCHEMBL11014352 0.65 CYP19A1 (0.42)
SCHEMBL2995208 0.65 CYP19A1 (0.39)
SCHEMBL20629891 0.65
SCHEMBL29222975 0.64 HSD11B1 (0.33)
SCHEMBL31668813 0.64 KMT2A (0.30)
SCHEMBL2990882 0.61
SCHEMBL8708051 0.61 LMNA (0.32)
SCHEMBL2992831 0.60 HSD17B10 (0.36)
SCHEMBL5409872 0.60 HSD17B10 (0.40)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2092033-B1 PRESSURE-SENSITIVE HOT-MELT ADHESIVES ADHERING TO FLEXIBLE SUBSTRATES HENKEL AG & CO KGAA (DE) 2011-11-16 EP disclosed
US-20110262415-A1 ERYTHROCYTE-BASED DELIVERY SYSTEM, METHOD OF PREPARATION AND USES THEREOF CNR - CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2011-10-27 US disclosed
EP-2092033-A1 PRESSURE-SENSITIVE HOT-MELT ADHESIVES ADHERING TO FLEXIBLE SUBSTRATES Henkel AG & Co. KGaA (DE) 2009-08-26 EP disclosed
WO-2008058781-A1 PRESSURE-SENSITIVE HOT-MELT ADHESIVES ADHERING TO FLEXIBLE SUBSTRATES HENKEL AG & CO. KGAA (DE) 2008-05-22 WO disclosed