SCHEMBL488967

SCHEMBL488967

OCC1=CC=CC(O)(CO)C1

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
SCHEMBL6708557 0.77
SCHEMBL21633854 0.69
SCHEMBL28482874 0.68 HDAC1 (0.33)
SCHEMBL28456196 0.66
SCHEMBL11600441 0.66
SCHEMBL28025890 0.65
SCHEMBL28354522 0.60
SCHEMBL4308456 0.59
SCHEMBL27705308 0.59
SCHEMBL28564544 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101460178-B Immune regulative RNA (SIMRA) compound for the stabilisation of TLR7 and TLR8 艾德拉药物股份有限公司 2016-12-07 CN claimed
US-9243050-B2 Stabilized immune modulatory RNA (SIMRA) compounds for TLR7 and TLR8 Idera Pharamaceuticals, Inc. (US) 2016-01-26 US claimed
EP-2021008-B1 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 IDERA PHARMACEUTICALS INC (US) 2015-12-02 EP claimed
US-20140308300-A1 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 NOVAQUEST CO-INVESTMENT FUND XV, L.P. 2014-10-16 US claimed
US-8853375-B2 Toll like receptor modulators IDERA PHARMACEUTICALS, INC. (US) 2014-10-07 US claimed
US-8759310-B2 Stabilized immune modulatory RNA (SIMRA) compounds for TLR7 and TLR8 IDERA PHARMACEUTICALS, INC. (US) 2014-06-24 US claimed
US-20130202584-A1 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 IDERA PHARMACEUTICALS, INC. 2013-08-08 US claimed
EP-2179061-B1 TOLL LIKE RECEPTOR MODULATORS IDERA PHARMACEUTICALS INC (US) 2012-10-03 EP claimed
US-8106173-B2 Stabilized immune modulatory RNA (SIMRA) compounds for TLR7 and TLR8 IDERA PHARMACEUTICALS, INC. (US) 2012-01-31 US claimed
EP-2179061-A2 TOLL LIKE RECEPTOR MODULATORS Idera Pharmaceuticals, Inc. (US) 2010-04-28 EP claimed
JP-2009533348-A 2009-09-17 JP claimed
US-20090053148-A1 TOLL LIKE RECEPTOR MODULATORS IDERA PHARMACEUTICALS, INC. 2009-02-26 US claimed
WO-2009023819-A2 TOLL LIKE RECEPTOR MODULATORS IDERA PHARMACEUTICALS, INC. (US) 2009-02-19 WO claimed
EP-2021008-A2 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 Idera Pharmaceuticals, Inc. (US) 2009-02-11 EP claimed
US-20080171712-A1 At least two oligonucleotides having modified purine bases, such as deazaguanosines or deaza-adenosines, linked by an alkyl or phenolic diol or triol; vaccines, DNA vaccines; anticarcinogenic, antiallergenic, antiinflammatory agents; bronchodilators IDERA PHARMACEUTICALS, INC. 2008-07-17 US claimed
WO-2007117686-A2 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 IDERA PHARMACEUTICALS, INC. (US) 2007-10-18 WO claimed
EP-2021008-B1 STABILIZED IMMUNE MODULATORY RNA (SIMRA) COMPOUNDS FOR TLR7 AND TLR8 IDERA PHARMACEUTICALS INC (US) 2015-12-02 EP disclosed