SCHEMBL4656234

SCHEMBL4656234

CC1(C)OC[C@H](N)[C@@H](O)CO1

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
SCHEMBL9807213 1.00
SCHEMBL9807214 1.00
SCHEMBL1947771 1.00
SCHEMBL4656389 1.00
Acetic Acid SCHEMBL4126300 0.92 APLNR (0.31)
Acetic Acid SCHEMBL7676712 0.92 APLNR (0.31)
SCHEMBL9356674 0.79 MEN1 (0.33)
SCHEMBL16668279 0.76
SCHEMBL16668143 0.76
SCHEMBL9451089 0.76 SPHK2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049543-B1 ACYCLIC AMINE INHIBITORS OF 5'-METHYLTHIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE CALLAGHAN INNOVATION RES LTD (NZ) 2014-11-05 EP disclosed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US disclosed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US disclosed
US-8383636-B2 Acyclic amine inhibitors of 5-methytioadenosine phosphorylase and nucleosidase INDUSTRIAL RESEARCH LIMITED (NZ) 2013-02-26 US disclosed
US-8383636-B2 Acyclic amine inhibitors of 5-methytioadenosine phosphorylase and nucleosidase INDUSTRIAL RESEARCH LIMITED (NZ) 2013-02-26 US disclosed
EP-2395005-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases Industrial Research Limited (NZ) 2011-12-14 EP disclosed
US-20110130412-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases BIOCRYST PHARMACEUTICALS, INC. 2011-06-02 US disclosed
US-20110130412-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases BIOCRYST PHARMACEUTICALS, INC. 2011-06-02 US disclosed
EP-2057165-B1 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES IND RES LTD (NZ) 2011-03-16 EP disclosed
US-20110046167-A1 ACYCLIC AMINE INHIBITORS OF 5-METHYTIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE ALBERT EINSTEIN COLLEGE OF MEDICINE 2011-02-24 US disclosed
EP-0684948-A1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME. DIAGNOSTIKFORSCHUNG INST (DE) 1995-12-06 EP disclosed
EP-0406992-B1 New non-ionic carboxamide contrast agent SCHERING AG (DE) 1995-03-15 EP disclosed
WO-1994019352-A1 MESO-TETRAPHENYL PORPHYRIN COMPLEX COMPOUNDS, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICALS CONTAINING THE SAME Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1994-09-01 WO disclosed
EP-0233249-B1 NON-IONIC POLYOL CONTRAST MEDIA FROM IONIC CONTRAST MEDIA COOK IMAGING CORP (US) 1993-11-24 EP disclosed
US-5035877-A Hydroxylated triiodo-isophthalamide derivative COOK IMAGING CORPORATION (US) 1991-07-30 US disclosed
EP-0406992-A2 New non-ionic carboxamide contrast agent SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-09 EP disclosed
US-4954348-A Non-ionic polyol contrast media from ionic contrast media COOK IMAGING CORPORATION (US) 1990-09-04 US disclosed
EP-0233249-A4 NON-IONIC POLYOL CONTRAST MEDIA FROM IONIC CONTRAST MEDIA. COOK MANAGING INC (US) 1988-10-06 EP disclosed
EP-0233249-A1 NON-IONIC POLYOL CONTRAST MEDIA FROM IONIC CONTRAST MEDIA. COOK MANAGING INC (US) 1987-08-26 EP disclosed
WO-1987000757-A1 NON-IONIC POLYOL CONTRAST MEDIA FROM IONIC CONTRAST MEDIA COOK IMAGING, INC. (US) 1987-02-12 WO disclosed