SCHEMBL458790

SCHEMBL458790

NCC1CCCCO1

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
SCHEMBL3466034 1.00
SCHEMBL3464562 1.00
Hydrochloric Acid SCHEMBL1919167 0.97
SCHEMBL31147786 0.97
SCHEMBL17011390 0.97
SCHEMBL226121 0.92
SCHEMBL31558 0.92
SCHEMBL226122 0.92
Fluoride SCHEMBL10649196 0.92
Hydrochloric Acid SCHEMBL17203269 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515435-B1 WASP-PROTECTING SMALL MOLECULES, COMPOSITIONS, METHODS AND USES THEREOF IN THE TREATMENT OF INNATE AND ACQUIRED IMMUNE-RELATED DISORDERS OR CONDITIONS UNIV BAR ILAN (IL) 2026-02-25 EP claimed
US-20210361642-A1 WASP-PROTECTING SMALL MOLECULES, COMPOSITIONS, METHODS AND USES THEREOF IN THE TREATMENT OF INNATE AND ACQUIRED IMMUNE-RELATED DISORDERS OR CONDITIONS BAR ILAN UNIVERSITY (IL) 2021-11-25 US claimed
EP-1885349-B1 Sulphamides for treatment of cancer MERCK SHARP & DOHME (GB) 2016-03-09 EP claimed
US-20110263580-A1 METHOD FOR TREATING ALZHEIMER'S DISEASE AND RELATED CONDITIONS MERCK SHARP & DOHME CORP. 2011-10-27 US claimed
WO-2008022013-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2008-02-21 WO claimed
JP-3880051-B2 2007-02-14 JP claimed
US-7138400-B2 Sulfamides as gamma-secretase inhibitors MERCK SHARP & DOHME LIMITED (GB) 2006-11-21 US claimed
EP-1334085-B1 SULFAMIDES AS GAMMA-SECRETASE INHIBITORS MERCK SHARP & DOHME (GB) 2005-08-24 EP claimed
JP-2004513108-A 2004-04-30 JP claimed
US-20040049038-A1 Sulfamides as gamma-secretase inhibitors MERCK SHARP & DOHME (UK) LIMITED (GB) 2004-03-11 US claimed
EP-1334085-A1 SULFAMIDES AS GAMMA-SECRETASE INHIBITORS MERCK SHARP & DOHME LTD. (GB) 2003-08-13 EP claimed
WO-2002036555-A1 SULFAMIDES AS GAMMA-SECRETASE INHIBITORS MERCK SHARP & DOHME LIMITED (GB) 2002-05-10 WO claimed
EP-0998946-A1 Non-porphyrin compound for use as a diagnosticum and/or pharmaceutical K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-05-10 EP claimed
WO-2000009169-A1 NON-PORPHYRIN COMPOUND FOR USE AS A DIAGNOSTICUM AND/OR PHARMACEUTICAL K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-02-24 WO claimed
WO-1992002259-A1 NOVEL COMPOSITIONS FOR MAGNETIC RESONANCE IMAGING MALLINCKRODT MEDICAL, INC. (US) 1992-02-20 WO claimed
US-5077037-A Novel compositions for magnetic resonance imaging MALLINCKRODT MEDICAL, INC. (US) 1991-12-31 US claimed
US-12617777-B2 GPR84 antagonists and uses thereof Liminal Biosciences Limited (GB) 2026-05-05 US disclosed
EP-4727944-A1 [1,2,4]-TRIAZOLO[4,3-B]PYRIDAZINE DERIVATIVES USEFUL AS A MEDICAMENT Perha Pharmaceuticals (FR) 2026-04-22 EP disclosed
US-3969365-A ANTIINFLAMMATORY, HYPOGLYCEMIC E. R. SQUIBB & SONS, INC. (US) 1976-07-13 US disclosed
US-3966760-A 2-Substituted-5,6-dimethoxyindazoles MORTON-NORWICH PRODUCTS, INC. (US) 1976-06-29 US disclosed