SCHEMBL694328

SCHEMBL694328

C=CCONC(=O)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
SCHEMBL9442160 0.81 MAPT (0.37)
SCHEMBL873544 0.80
SCHEMBL1894433 0.80
SCHEMBL873545 0.78
SCHEMBL2185277 0.76 MAPT (0.37)
SCHEMBL28198217 0.76 MAPT (0.46)
SCHEMBL2364872 0.76 GAA (0.38)
SCHEMBL19137291 0.75 TDP1 (0.32)
SCHEMBL9993851 0.75 MAPT (0.44)
SCHEMBL28510539 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457215-B1 3'-deamino-4'-deoxy-4'-amino-8-fluoroanthracyclines and processes for their preparation MENARINI FARMA IND (IT) 1996-01-17 EP claimed
EP-0457215-A1 3'-deamino-4'-deoxy-4'-amino-8-fluoroanthracyclines and processes for their preparation A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1991-11-21 EP claimed
JP-4226972-A None JP disclosed
US-12331057-B2 Modulators of alpha-1 antitrypsin VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-17 US disclosed
WO-2024251921-A1 ANTHRACYCLINES ACADEMISCH ZIEKENHUIS LEIDEN H.O.D.N. LUMC (NL) 2024-12-12 WO disclosed
EP-4474386-A1 ANTHRACYCLINES Academisch Ziekenhuis Leiden h.o.d.n. LUMC (NL) 2024-12-11 EP disclosed
US-20240336614-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED 2024-10-10 US disclosed
US-11884672-B2 Modulators of alpha-1 antitrypsin VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-01-30 US disclosed
US-20230193248-A1 METHODS FOR PROTEIN IDENTIFICATION BASED ON ENCODING REACTIONS Encodia, Inc. (US) 2023-06-22 US disclosed
EP-3969440-A1 CONDENSED TRICYCLIC PYRROLES AS ALPHA-1 ANTITRYPSIN MODULATORS Vertex Pharmaceuticals Incorporated (US) 2022-03-23 EP disclosed
CN-114096542-A Condensed tricyclic pyrroles as alpha-1 antitrypsin modulators 弗特克斯药品有限公司 2022-02-25 CN disclosed
WO-1994024088-A1 DEALLYLATION REAGENT AND DEALLYLATION METHOD USING SAID REAGENT RHONE POULENC CHIMIE (FR) 1994-10-27 WO disclosed
US-5221754-A Easily removable blocking groups to protect primary or secondary amines RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-06-22 US disclosed
EP-0496836-A4 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS 1993-05-05 EP disclosed
JP-H04226972-A 3'-DEAMINO-4'-DEOXY-4'-AMINO-8-FLUOROANTHRACYCLIN AND PREPARATION THEREOF A MENARINI IND FARM RIUNITE SRL 1992-08-17 JP disclosed
EP-0496836-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS. RES CORP TECHNOLOGIES INC (US) 1992-08-05 EP disclosed
EP-0457215-A1 3'-deamino-4'-deoxy-4'-amino-8-fluoroanthracyclines and processes for their preparation A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE S.R.L. (IT) 1991-11-21 EP disclosed
WO-1991005564-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-05-02 WO disclosed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP disclosed
US-4226612-A Certain herbicidal (2-oxo-3-oxazolidinyl)phenylureas SHELL OIL COMPANY (US) 1980-10-07 US disclosed