SCHEMBL536388

SCHEMBL536388

O=C(O)CCC(C1CN1)C(C(CCC(=O)O)C1CN1)(C(CCC(=O)O)C1CN1)C(CO)(CO)CCO

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
SCHEMBL1852982 0.71 FOLH1 (0.39)
SCHEMBL1848279 0.66 CAMK2A (0.38)
SCHEMBL1855376 0.65 GSTK1 (0.40)
SCHEMBL435282 0.61 RNPEP (0.32)
SCHEMBL129335 0.60 SLC22A6 (0.30)
SCHEMBL2060005 0.60
SCHEMBL9805867 0.59 LMNA (0.31)
SCHEMBL244677 0.59
SCHEMBL11385435 0.59
SCHEMBL16105119 0.58 NPSR1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023078794-A1 BIOCIDAL POLYMER BLEND LANXESS DEUTSCHLAND GMBH (DE) 2023-05-11 WO claimed
EP-4176721-A1 BIOCIDAL POLYMER BLENDS LANXESS Deutschland GmbH (DE) 2023-05-10 EP claimed
EP-1776209-B1 COATED ABRASIVE ARTICLE WITH TIE LAYER, AND METHOD OF MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES CO (US) 2008-03-26 EP claimed
EP-1773544-B1 COATED ABRASIVE ARTICLE WITH COMPOSITE TIE LAYER, AND METHOD OF MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES CO (US) 2008-03-26 EP claimed
WO-2023078794-A1 BIOCIDAL POLYMER BLEND LANXESS DEUTSCHLAND GMBH (DE) 2023-05-11 WO disclosed
EP-4176721-A1 BIOCIDAL POLYMER BLENDS LANXESS Deutschland GmbH (DE) 2023-05-10 EP disclosed
EP-2413697-B1 STABILISATION OF COMPOUNDS CONTAINING IODINE LANXESS DEUTSCHLAND GMBH (DE) 2017-11-08 EP disclosed
EP-2779830-A1 STABILIZATION OF COMPOUNDS CONTAINING IODINE HAVING POLYMERS COMPRISING NITROGEN LANXESS Deutschland GmbH (DE) 2014-09-24 EP disclosed
WO-2013072427-A1 STABILIZATION OF COMPOUNDS CONTAINING IODINE HAVING POLYMERS COMPRISING NITROGEN LANXESS DEUTSCHLAND GMBH (DE) 2013-05-23 WO disclosed
EP-2594132-A1 Stabilisation of iodine containing compounds with polymers containing nitrogen Lanxess Deutschland GmbH (DE) 2013-05-22 EP disclosed
WO-2012076699-A1 BIOCIDE MICROCAPSULE FORMULATIONS CONTAINING STABILISED IODINE-CONTAINING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2012-06-14 WO disclosed
EP-2462805-A1 Formulations containing stabilised compounds containing iodine LANXESS Deutschland GmbH (DE) 2012-06-13 EP disclosed
EP-2440043-A1 INORGANIC CARRIER MATERIALS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS Lanxess Deutschland GmbH (DE) 2012-04-18 EP disclosed
EP-2413697-A1 STABILIZATION OF COMPOUNDS COMPRISING IODINE LANXESS Deutschland GmbH (DE) 2012-02-08 EP disclosed
WO-2011000794-A1 POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2011-01-06 WO disclosed
EP-2270087-A1 Heterocyclic 3-ring connections and polymers containing iodine compounds LANXESS Deutschland GmbH (DE) 2011-01-05 EP disclosed
WO-2010142795-A2 INORGANIC CARRIER MATERIALS CONTAINING NITROGEN LANXESS DEUTSCHLAND GMBH (DE) 2010-12-16 WO disclosed
WO-2010142790-A1 INORGANIC CARRIER MATERIALS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2010-12-16 WO disclosed
WO-2010112387-A1 STABILIZATION OF COMPOUNDS COMPRISING IODINE LANXESS DEUTSCHLAND GMBH (DE) 2010-10-07 WO disclosed
EP-2236033-A1 Stabilisation of compounds containing iodine LANXESS Deutschland GmbH (DE) 2010-10-06 EP disclosed