SCHEMBL5016894

SCHEMBL5016894

CC1NC1C(C)C(=O)O.CC1NC1C(C)C(=O)O.CC1NC1C(C)C(=O)O.CCC(CO)(CO)CO

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
SCHEMBL2177797 0.76
SCHEMBL11357865 0.75 CHRM1 (0.39)
SCHEMBL16752030 0.75 CHRM1 (0.39)
Lactic Acid SCHEMBL3674426 0.73 TP53 (0.52)
SCHEMBL17667485 0.71 RNPEP (0.38)
SCHEMBL28215927 0.71 RNPEP (0.38)
SCHEMBL444542 0.71 RNPEP (0.38)
SCHEMBL15809468 0.71 RNPEP (0.38)
SCHEMBL719639 0.71 LCK (0.38)
Bicarbonate SCHEMBL8777797 0.70 FFAR3 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2833862-B1 COATING COMPOSITIONS FOR PROTEINACEOUS SUBSTRATES AND METHODS OF PRIMING AND TOPCOATING PROTEINACEOUS SUBSTRATES THEREWITH MAD RIVER SCIENCE (US) 2017-07-26 EP claimed
US-20040010099-A1 Using complex as free radical catalyst LOCTITE (R&D) LTD. 2004-01-15 US claimed
EP-3107974-A1 DUAL-PACK ADHESIVE AND STRUCTURAL PIECE CONTAINING SAME 3M Innovative Properties Company (US) 2016-12-28 EP disclosed
US-20160347975-A1 DUAL-PACK ADHESIVE AND STRUCTURAL PIECE CONTAINING SAME 3M INNOVATIVE PROPERTIES COMPANY 2016-12-01 US disclosed
WO-2015126801-A1 DUAL-PACK ADHESIVE AND STRUCTURAL PIECE CONTAINING SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-08-27 WO disclosed
US-20080241637-A1 Polymerizable Compositions for Bonding and Sealing Low Surface Energy Substrates for Fuel Cells BURDZY MATTHEW P 2008-10-02 US disclosed
US-7098279-B2 Non-flammable and non-combustible adhesive bonding systems having adherence to low energy surfaces LOCTITE (R&D) LIMITED (IE) 2006-08-29 US disclosed
US-6939932-B2 Using complex as free radical catalyst LOCTITE (R&D) LIMITED (IE) 2005-09-06 US disclosed
US-6867271-B1 Non-flammable and non-combustible adhesive bonding systems having adherence to low energy surfaces HENKEL CORPORATION (US) 2005-03-15 US disclosed
US-20040077783-A1 Non-flammable and non-combustible adhesive bonding systems having adherence to low energy surfaces HENKEL LOCTITE CORPORATION 2004-04-22 US disclosed
US-20040010099-A1 Using complex as free radical catalyst LOCTITE (R&D) LTD. 2004-01-15 US disclosed
WO-2003035703-A1 NON-FLAMMABLE AND NON-COMBUSTIBLE ADHESIVE BONDING SYSTEMS HAVING ADHERENCE TO LOW ENERGY SURFACES HENKEL CORPORATION (US) 2003-05-01 WO disclosed