SCHEMBL4647

SCHEMBL4647

OB(O)c1cccnc1

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
SCHEMBL29376605 1.00
Hydrochloric Acid SCHEMBL7002225 0.98 ENPP2 (0.46)
SCHEMBL28265047 0.98 ENPP2 (0.46)
Water SCHEMBL13835615 0.98 ENPP2 (0.46)
SCHEMBL1617465 0.93 ENPP2 (0.42)
Phenylboronic Acid SCHEMBL1668705 0.93 CA4 (0.61)
SCHEMBL28612539 0.93 MGLL (0.46)
SCHEMBL5498992 0.88 TSHR (0.40)
SCHEMBL20600817 0.88 CA4 (0.38)
Bicarbonate SCHEMBL28681546 0.88 ALDH1A1 (0.42)

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

Appears in 12820 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528777-B2 Quinazolinones derivatives for treatment of non-alcoholic fatty liver disease, preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2026-01-20 US claimed
US-20250194617-A1 Materials and Methods for Extending Shelf-Life of Foods JP LABORATORIES, INC. 2025-06-19 US claimed
CN-119900028-B Acid-resistant and temperature-resistant organic corrosion inhibitor, preparation method and application thereof 广饶源润新材料有限公司 2025-06-17 CN claimed
US-20250177537-A1 AN ANTIBIOTIC, METHOD OF PREPARATION AND METHOD OF TREATMENT THEREOF NATIONAL TAIWAN UNIVERSITY (TW) 2025-06-05 US claimed
US-20250169514-A1 Materials and Methods for Extending Shelf-Life of Foods JP LABORATORIES, INC. 2025-05-29 US claimed
CN-119999697-A Modified graphite phase carbon nitride material grafted with boric acid groups, preparation method and application thereof 扬州大学 2025-05-16 CN claimed
CN-119900028-A Acid-resistant and temperature-resistant organic corrosion inhibitor, preparation method and application thereof 广饶源润新材料有限公司 2025-04-29 CN claimed
CN-119841799-A Polyphenol compound, and preparation method and application thereof 复旦大学 2025-04-18 CN claimed
CN-119034695-A Preparation method and application of boron affinity imprinting COF microsphere adsorbent 江苏大学 2024-11-29 CN claimed
CN-118812533-A Azapyrazinophenanthroline small-molecule organic corrosion inhibitor and preparation method thereof 洛阳船舶材料研究所(中国船舶集团有限公司第七二五研究所) 2024-10-22 CN claimed
EP-2059227-A2 POLYMER SYSTEMS FOR LUNG VOLUME REDUCTION THERAPY Aeris Therapeutics, Inc. (US) 2009-05-20 EP claimed
JP-2008521903-A 2008-06-26 JP claimed
WO-2008039827-A2 POLYMER SYSTEMS FOR LUNG VOLUME REDUCTION THERAPY AERIS THERAPEUTICS, INC. (US) 2008-04-03 WO claimed
EP-1831206-A2 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI Pharmaceuticals, Inc. (US) 2007-09-12 EP claimed
WO-2006060381-A2 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI PHARMACEUTICALS, INC. (US) 2006-06-08 WO claimed
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. 2006-06-01 US claimed
US-7053079-B2 Dihydroxy (3-pyridyl) borane compounds KOEI CHEMICAL COMPANY, LIMITED (JP) 2006-05-30 US claimed
US-20040254076-A1 Dihydroxy (3-pyridyl) borane compounds KOEI CHEMICAL COMPANY, LIMITED (JP) 2004-12-16 US claimed
EP-1460079-A1 DIHYDROXY(3-PYRIDYL)BORANE COMPOUNDS Koei Chemical Co., Ltd. (JP) 2004-09-22 EP claimed
WO-2003080621-A1 PROCESS AND INTERMEDIATES TO SUBSTITUTED IMIDAZOPYRIMIDINES MERCK & CO., INC. (US) 2003-10-02 WO claimed