SCHEMBL3831498

SCHEMBL3831498

NC(CC(=O)OO)C(=O)OO

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
Sulfuric Acid SCHEMBL9257038 0.91 — —
SCHEMBL28611044 0.84 SMN1; SMN2 (0.34) —
SCHEMBL17395891 0.80 ALOX15 (0.34) —
SCHEMBL28753674 0.80 SLC22A6 (0.38) —
SCHEMBL3831500 0.80 SLC22A6 (0.38) —
SCHEMBL6659100 0.80 ALOX15 (0.34) —
SCHEMBL29011629 0.80 GRIK1 (0.48) —
SCHEMBL8038645 0.76 SLC1A1 (0.38) —
SCHEMBL1577671 0.74 — —
SCHEMBL1577670 0.73 SLC7A5 (0.56) —

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743335-B1 Hyperbranched polyaspartate esters and a process for their preparation BAYER AG (US) 2001-09-26 — — EP claimed
EP-0743335-A2 Hyperbranched polyaspartate esters and a process for their preparation Bayer Corporation (US) 1996-11-20 — — EP claimed
US-5561214-A REACTION MALEIC OR FUMARIC ESTER WITH AMINO ALCOHOLS BAYER CORPORATION (US) 1996-10-01 — — US claimed
EP-0316809-B1 Salts of amino-(poly)percarboxylic acids AUSIMONT SPA (IT) 1993-11-03 — — EP claimed
EP-0316809-A2 Salts of amino-(poly)percarboxylic acids AUSIMONT S.p.A. (IT) 1989-05-24 — — EP claimed
EP-3655390-B1 NOVEL AMINO ACIDS BEARING A NORBORNENE MOIETY VALANX BIOTECH GMBH (AT) 2023-03-29 — — EP disclosed
EP-3994260-A1 A METHOD FOR THE PRODUCTION OF PLANTS WITH ALTERED PHOTORESPIRATION AND IMPROVED CO2 FIXATION Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-05-11 — — EP disclosed
EP-1670748-B1 PROCESS FOR PREPARING ASPARTATES BAYER MATERIALSCIENCE LLC (US) 2009-09-23 — — EP disclosed
EP-1670849-B1 ASPARTATE DERIVATIVES AND PROCESS FOR THEIR PREPARATION BAYER MATERIALSCIENCE LLC (US) 2009-03-25 — — EP disclosed
US-7276572-B2 Process for preparing aspartates BAYER MATERIALSCIENCE LLC (US) 2007-10-02 — — US disclosed
EP-1670748-A2 PROCESS FOR PREPARING ASPARTATES Bayer MaterialScience LLC (US) 2006-06-21 — — EP disclosed
WO-2005035482-A2 PROCESS FOR PREPARING ASPARTATES BAYER MATERIALSCIENCE LLC (US) 2005-04-21 — — WO disclosed
EP-0744419-A1 Hydroxy-functional prepolymers containing hydantoin group precursors and their use in coating compositions Bayer Corporation (US) 1996-11-27 — — EP disclosed
EP-0744425-A2 Blocked polyisocyanates with improved thermal stability Bayer Corporation (US) 1996-11-27 — — EP disclosed
EP-0744427-A2 Blocked polyisocyanates with improved thermal stability Bayer Corporation (US) 1996-11-27 — — EP disclosed
EP-0743335-A2 Hyperbranched polyaspartate esters and a process for their preparation Bayer Corporation (US) 1996-11-20 — — EP disclosed
EP-0743333-A1 Hydroxy-functional polyhydantoin prepolymers and their use in coating compositions Bayer Corporation (US) 1996-11-20 — — EP disclosed
US-5561200-A Blocked polyisocyanates with improved thermal stability BAYER CORPORATION (US) 1996-10-01 — — US disclosed
US-5561214-A REACTION MALEIC OR FUMARIC ESTER WITH AMINO ALCOHOLS BAYER CORPORATION (US) 1996-10-01 — — US disclosed
EP-0316809-B1 Salts of amino-(poly)percarboxylic acids AUSIMONT SPA (IT) 1993-11-03 — — EP disclosed
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