SCHEMBL9686981

SCHEMBL9686981

O=C1OCCC/C1=C\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
SCHEMBL9686986 1.00
SCHEMBL14972809 0.98 NAMPT (0.47)
SCHEMBL28943338 0.98 NAMPT (0.47)
SCHEMBL29597368 0.98 NAMPT (0.47)
SCHEMBL3972493 0.86
SCHEMBL2834476 0.86
SCHEMBL9943877 0.86
SCHEMBL1311913 0.84
SCHEMBL980488 0.77
SCHEMBL30881494 0.76 NAMPT (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4218754-B1 VANZACAFTOR FOR USE IN THE TREATMENT OF CYSTIC FIBROSIS VERTEX PHARMA (US) 2026-03-25 EP disclosed
EP-4648753-B1 COMPOSITIONS FOR THE TREATMENT OF CFTR-MEDIATED DISEASES VERTEX PHARMA (US) 2026-02-18 EP disclosed
US-20260008779-A1 CRYSTALLINE FORMS OF CFTR MODULATORS VERTEX PHARMA (US) 2026-01-08 US disclosed
EP-4648753-A1 COMPOSITIONS FOR THE TREATMENT OF CFTR-MEDIATED DISEASES Vertex Pharmaceuticals Incorporated (US) 2025-11-19 EP disclosed
US-20250288563-A1 METHODS OF TREATMENT FOR CYSTIC FIBROSIS VERTEX PHARMACEUTICALS INCORPORATED 2025-09-18 US disclosed
US-20250248981-A1 COMPOSITIONS FOR THE TREATMENT OF CFTR-MEDIATED DISEASES VERTEX PHARMACEUTICALS INCORPORATED 2025-08-07 US disclosed
EP-3880197-B9 METHODS OF TREATMENT FOR CYSTIC FIBROSIS VERTEX PHARMA (US) 2025-07-02 EP disclosed
US-12319693-B2 Crystalline forms of CFTR modulators VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-03 US disclosed
US-20250051326-A1 CRYSTALLINE FORMS OF CFTR MODULATORS VERTEX PHARMACEUTICALS INCORPORATED 2025-02-13 US disclosed
US-12186306-B2 Methods of treatment for cystic fibrosis VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-01-07 US disclosed
US-20210047350-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2021-02-18 US disclosed
US-20210047323-A1 CRYSTALLINE FORMS OF CFTR MODULATORS VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2021-02-18 US disclosed
US-20210047345-A1 PROCESS OF MAKING CFTR MODULATORS VERTEX PHARMACEUTICALS INCORPORATED 2021-02-18 US disclosed
US-20210047323-A1 CRYSTALLINE FORMS OF CFTR MODULATORS VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2021-02-18 US disclosed
WO-2020102346-A1 METHODS OF TREATMENT FOR CYSTIC FIBROSIS VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-05-22 WO disclosed
WO-2019161078-A1 MACROCYCLES AS MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR, PHARMACEUTICAL COMPOSITIONS THEREOF, THEIR USE IN THE TREATMENT OF CYCSTIC FIBROSIS, AND PROCESS FOR MAKING THEM VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-08-22 WO disclosed
US-20190248809-A1 Modulators of Cystic Fibrosis Transmembrane Conductance Regulator, Pharmaceutical Compositions, Methods of Treatment, and Process for Making the Modulators VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-08-15 US disclosed
US-20190248809-A1 Modulators of Cystic Fibrosis Transmembrane Conductance Regulator, Pharmaceutical Compositions, Methods of Treatment, and Process for Making the Modulators VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-08-15 US disclosed
EP-0307078-B1 QUINOLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1992-08-26 EP disclosed
US-5051508-A Antisecretory agents and enzyme inhibitors as antiulcer agents SMITHKLINE BECKMAN INTERCREDIT B.V. (NL) 1991-09-24 US disclosed