SCHEMBL4954752

SCHEMBL4954752

O=C[C@@H]1C[C@H](O)CN1

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
SCHEMBL3688615 1.00
SCHEMBL7777452 1.00
SCHEMBL8381180 1.00
SCHEMBL3478911 1.00
SCHEMBL16051190 1.00
SCHEMBL1983125 1.00
SCHEMBL27753942 1.00
SCHEMBL14326431 1.00
Hydrochloric Acid SCHEMBL30177889 0.98
Hydrochloric Acid SCHEMBL30187341 0.98

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970278-A1 PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS AbbVie Inc. (US) 2016-01-20 EP claimed
WO-2014139328-A1 PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS ABBVIE INC. (US) 2014-09-18 WO claimed
EP-1924275-B1 THIO-CONTAINING INHIBITORS OF AMINOPEPTIDASE P, COMPOSITIONS THEREOF AND METHOD OF USE SIMMONS WILLIAM H (US) 2012-08-08 EP claimed
US-20070060525-A1 Thio-containing inhibitors of aminopeptidase P, compositions thereof and method of use SIMMONS WILLIAM H 2007-03-15 US claimed
WO-2024049979-A2 NOVEL IONIZABLE LIPIDS AND LIPID NANOPARTICLES AND METHODS OF USING THE SAME SENDA BIOSCIENCES, INC. (US) 2024-03-07 WO disclosed
EP-2970278-A1 PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS AbbVie Inc. (US) 2016-01-20 EP disclosed
WO-2014139328-A1 PYRROLO[2,3-B]PYRIDINE CDK9 KINASE INHIBITORS ABBVIE INC. (US) 2014-09-18 WO disclosed
EP-1924275-B1 THIO-CONTAINING INHIBITORS OF AMINOPEPTIDASE P, COMPOSITIONS THEREOF AND METHOD OF USE SIMMONS WILLIAM H (US) 2012-08-08 EP disclosed
US-20120101006-A1 Methods and Compositions for the Production of Orthogonal tRNA-Aminoacyl tRNA Synthetase Pairs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-04-26 US disclosed
US-7741281-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-22 US disclosed
US-20090227002-A1 Methods and compositions for the production of orthogonal tRNA-aminoacyl tRNA synthetase pairs THE SCRIPPS RESEARCH INSTITUTE and THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-09-10 US disclosed
US-7390789-B2 Thio-containing inhibitors of aminopeptidase P, and compositions thereof SIMMONS WILLIAM H 2008-06-24 US disclosed
US-7323447-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-29 US disclosed
US-20070060525-A1 Thio-containing inhibitors of aminopeptidase P, compositions thereof and method of use SIMMONS WILLIAM H 2007-03-15 US disclosed