SCHEMBL303706

SCHEMBL303706

CC(C)(CC#N)OC=O

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
Ammonia Solution, Strong SCHEMBL28756972 0.98 TDP1 (0.40)
SCHEMBL14353489 0.80
SCHEMBL28088 0.69
SCHEMBL13531697 0.69
SCHEMBL1456263 0.68
SCHEMBL11469145 0.68 CTSK (0.30)
SCHEMBL1447666 0.67
SCHEMBL20201060 0.67
SCHEMBL1335386 0.67
SCHEMBL6200818 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317161-A1 A PROCESS FOR THE PREPARATION OF PASIREOTIDE AURO PEPTIDES LTD (IN) 2021-10-14 US claimed
EP-3053944-B1 METHOD FOR PRODUCING POLYALKYLENE GLYCOL DERIVATIVE HAVING AMINO GROUP AT END, POLYMERIZATION INITIATOR FOR USE IN THE SAME, AND ALCOHOL COMPOUND AS RAW MATERIAL FOR THE POLYMERIZATION INITIATOR SHINETSU CHEMICAL CO (JP) 2021-10-06 EP claimed
EP-3233899-B1 A PROCESS FOR THE PREPARATION OF PASIREOTIDE AURO PEPTIDES LTD (IN) 2020-06-24 EP claimed
EP-3233899-A1 A PROCESS FOR THE PREPARATION OF PASIREOTIDE Auro Peptides LTD (IN) 2017-10-25 EP claimed
WO-2016097962-A1 A PROCESS FOR THE PREPARATION OF PASIREOTIDE AURO PEPTIDES LTD (IN) 2016-06-23 WO claimed
US-20120214994-A1 (3-FLUORO-2-HYDROXY)PROPYL-FUNCTIONALIZED ARYL DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR THE DIAGNOSIS OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASES FUTURECHEM CO., LTD. (KR) 2012-08-23 US claimed
JP-4623828-B2 2011-02-02 JP claimed
EP-1102782-B1 STRUCTURAL ANALOGS OF AMINE BASES AND NUCLEOSIDES BIO RAD LABORATORIES (US) 2006-03-29 EP claimed
EP-1483286-A1 A PROCESS FOR THE PRODUCTION OF RAMOPLANIN-LIKE AMIDE DERIVATIVES Vicuron Pharmaceuticals, Inc. (US) 2004-12-08 EP claimed
WO-2003076460-A1 A PROCESS FOR THE PRODUCTION OF RAMOPLANIN-LIKE AMIDE DERIVATIVES VICURON PHARMACEUTICALS INC. (US) 2003-09-18 WO claimed
WO-1997034924-A1 PROCESS AND INTERMEDIATES FOR THE SYNTHESIS OF LHRH ANTAGONISTS ABBOTT LABORATORIES (US) 1997-09-25 WO claimed
EP-0443532-B1 Temporary minimal protection synthesis of LH-RH analogs SYNTEX INC (US) 1994-06-29 EP claimed
EP-0270651-B1 NOVEL DEOXYRIBONUCLEOSIDE PHOSPHORAMIDITES AND THEIR USE FOR THE PREPARATION OF OLIGONUCLEOTIDES CALIFORNIA INST OF TECHN (US) 1994-06-15 EP claimed
US-5212288-A Luteinizing hormone-releasing hormone antagonists SYNTEX (U.S.A.) INC. (US) 1993-05-18 US claimed
EP-0443532-A2 Temporary minimal protection synthesis of LH-RH analogs SYNTEX (U.S.A.) INC. (US) 1991-08-28 EP claimed
EP-0170280-B1 NOVEL INTERMEDIATES AND PROCESS FOR THE PREPARATION OF 3-ACYLAMINO-1-HYDROXY-2-AZETIDINONES E.R. Squibb &amp; Sons, Inc. (US) 1990-12-05 EP claimed
US-4581170-A N-hydroxyl protecting groups and process and intermediates for the preparation of 3-acylamino-1-hydroxy-2-azetidinones E. R. SQUIBB & SONS, INC. (US) 1986-04-08 US claimed
EP-0170280-A1 Novel intermediates and process for the preparation of 3-acylamino-1-hydroxy-2-azetidinones E.R. Squibb &amp; Sons, Inc. (US) 1986-02-05 EP claimed
US-4535167-A CONDENSATION OF ACID AND ALDEHYDE FOLLOWED BY REDUCTIVE CLEAVAGE OF OXAZOLIDINONE INTERMEDIATE MERCK & CO. INC. (US) 1985-08-13 US claimed
US-4108846-A FOR PRODUCTION OF POLYPEPTIDES HOFFMANN-LA ROCHE INC. 1978-08-22 US claimed