SCHEMBL4299816

SCHEMBL4299816

CC(C)(C)CC(C)(C)C[O]

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
SCHEMBL2226249 0.76
SCHEMBL7539944 0.72 TSHR (0.36)
SCHEMBL15972107 0.72 TSHR (0.36)
SCHEMBL2612612 0.71 CYP2D6 (0.33)
SCHEMBL15361 0.71
SCHEMBL10486974 0.69 TSHR (0.33)
SCHEMBL20957515 0.69
SCHEMBL3403436 0.69
Ethane SCHEMBL27264482 0.68
SCHEMBL27974496 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760904-A1 METHOD FOR PRODUCING A MOLDED FOAM ELEMENT Eurofoam GmbH (AT) 2014-08-06 EP disclosed
WO-2012135888-A1 METHOD FOR PRODUCING A MOLDED FOAM ELEMENT EUROFOAM GMBH (AT) 2012-10-11 WO disclosed
EP-1463506-B1 SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF AURORA KINASES ASTRAZENECA AB (SE) 2009-10-21 EP disclosed
US-20090215770-A1 Substituted Quinazoline Derivatives as Inhibitors of Aurora Kinases ASTRAZENECA AB (SE) 2009-08-27 US disclosed
CN-100491372-C Substituted quinazoline derivatives as inhibitors of aurora kinase ASTRAZENECA AB (SE) 2009-05-27 CN disclosed
US-7402585-B2 Substituted quinazoline derivatives as inhibitors of aurora kinases ASTRAZENECA AB (SE) 2008-07-22 US disclosed
US-20050070561-A1 Substituted quinazoline derivatives as inhibitors of aurora kinases ASTRAZENECA AB (SE) 2005-03-31 US disclosed
EP-1463506-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF AURORA KINASES Astrazeneca AB (SE) 2004-10-06 EP disclosed
WO-2003055491-A1 SUBSTITUTED QUINAZOLINE DERIVATIVES AS INHIBITORS OF AURORA KINASES ASTRAZENECA AB (SE) 2003-07-10 WO disclosed