SCHEMBL3454869

SCHEMBL3454869

[CH2]CCC(C)N(C)C

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
SCHEMBL23425906 0.79 CHRNB2 (0.46)
SCHEMBL385837 0.76
SCHEMBL14175020 0.71
SCHEMBL12344858 0.71
SCHEMBL16837521 0.71 CHRNB2 (0.41)
SCHEMBL436448 0.71
SCHEMBL986680 0.71
SCHEMBL3454601 0.71
SCHEMBL11563132 0.69
SCHEMBL16439256 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666129-B1 COMPOSITE POROUS MEMBRANE ASAHI KASEI MEDICAL CO LTD (JP) 2017-06-21 EP disclosed
WO-2014160811-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROPATHY CHILDREN'S MEDICAL CENTER CORPORATION (US) 2014-10-02 WO disclosed
EP-2039701-B1 20-Keto-11Beta-Arylsteroids and their Derivatives having agonist or antagonist hormonal activity RES TRIANGLE INST (US) 2014-04-23 EP disclosed
EP-2240177-A2 TREATMENTS FOR NEUROPATHY Children's Medical Center Corporation (US) 2010-10-20 EP disclosed
WO-2009102570-A2 TREATMENTS FOR NEUROPATHY CHILDREN'S MEDICAL CENTER CORPORATION (US) 2009-08-20 WO disclosed
EP-2039701-A2 20-keto-11beta-arylsteroids and their derivatives having agonist or antagonist hormonal properties RESEARCH TRIANGLE INSTITUTE (US) 2009-03-25 EP disclosed
EP-1666129-A1 COMPOSITE POROUS MEMBRANE AND PROCESS FOR PRODUCING THE SAME Asahi Kasei Kabushiki Kaisha (JP) 2006-06-07 EP disclosed
EP-1060186-A4 20-KETO-11BETA-ARYLSTEROIDS AND THEIR DERIVATIVES HAVING AGONIST OR ANTAGONIST HORMONAL PROPERTIES RES TRIANGLE INST (US) 2005-05-04 EP disclosed
CN-1298409-A 20-keto-11&amp;beta, -arylsteroids and their derivatives having agonist or antagonist hormonal properties RES TRIANGLE INST (US) 2001-06-06 CN disclosed
EP-1060186-A1 20-KETO-11BETA-ARYLSTEROIDS AND THEIR DERIVATIVES HAVING AGONIST OR ANTAGONIST HORMONAL PROPERTIES RESEARCH TRIANGLE INSTITUTE (US) 2000-12-20 EP disclosed
US-6020328-A 20-keto-11β-arylsteroids and their derivatives having agonist or antagonist hormonal properties RESEARCH TRIANGLE INSTITUTE (US) 2000-02-01 US disclosed
WO-1999045022-A1 20-KETO-11β-ARYLSTEROIDS AND THEIR DERIVATIVES HAVING AGONIST OR ANTAGONIST HORMONAL PROPERTIES RESEARCH TRIANGLE INSTITUTE (US) 1999-09-10 WO disclosed
EP-0542369-B1 Self-extinguishing polymeric compositions MINI RICERCA SCIENT TECNOLOG (IT) 1998-05-13 EP disclosed