SCHEMBL366401

SCHEMBL366401

C=C(C)COC=C(C)OC

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
SCHEMBL2955965 0.71 HSD17B10 (0.35)
SCHEMBL9280106 0.70
SCHEMBL9058918 0.70
SCHEMBL2771284 0.69
SCHEMBL304934 0.69
SCHEMBL2627714 0.68
SCHEMBL1695588 0.67
SCHEMBL12163199 0.66
SCHEMBL8680922 0.66
SCHEMBL16019150 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070879-A1 REDUCTION OF ANTIBIOTIC ACTIVITY OR CONCENTRATION IN BIOLOGICAL SAMPLES USING MOLECULARLY IMPRINTED POLYMERS BECTON, DICKINSON AND COMPANY (US) 2012-03-22 US disclosed
US-20120012530-A1 MOLECULARLY IMPRINTED POLYMER ION EXCHANGE RESINS JOHNS HOPKINS UNIVERSITY (US) 2012-01-19 US disclosed
EP-1733211-B1 PROCESSABLE MOLECULARLY IMPRINTED POLYMERS UNIV JOHNS HOPKINS (US) 2012-01-11 EP disclosed
US-8058208-B2 Beads having properly sized cavities for selective sequestering of specific inorganic ions from liquid medium; suspension copolymerization of styrene, divinylbenzene and reactive complex then removing metal ion; water clean up THE JOHNS HOPKINS UNIVERSITY (US) 2011-11-15 US disclosed
EP-1800186-B1 AN IMPRINTED POLYMER SUPPORT AGENCY SCIENCE TECH & RES (SG) 2011-05-11 EP disclosed
WO-2011014923-A1 MOLECULARLY IMPRINTED POLYMERS, METHODS FOR THEIR PRODUCTION AND USES THEREOF MONASH UNIVERSITY (AU) 2011-02-10 WO disclosed
US-20080144002-A1 Molecularly Imprinted Polymer Sensor Device JOHNS HOPKINS UNIVERSITY 2008-06-19 US disclosed