SCHEMBL3956602

SCHEMBL3956602

Bc1ccc[nH]1

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
SCHEMBL427943 0.97
SCHEMBL7265608 0.83
SCHEMBL5148010 0.67
SCHEMBL13470772 0.65
SCHEMBL1377726 0.65 DAO (0.35)
Potassium Ion SCHEMBL5263144 0.63
Hydrochloric Acid SCHEMBL7988951 0.62 HDAC6 (0.40)
SCHEMBL30659527 0.62
SCHEMBL21135630 0.62 AURKA (0.38)
SCHEMBL826964 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115389697-B Mixed spontaneous combustion ionic liquid synthesis and ignition boundary determination method 西安交通大学 2024-09-06 CN claimed
WO-2023187012-A1 COMPOSITIONS INCLUDING AQUEOUS AMINE BORANE COMPLEXES AND POLYNUCLEOTIDES, AND METHODS OF USING THE SAME TO DETECT METHYLCYTOSINE OR HYDROXYMETHYLCYTOSINE ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-05 WO claimed
CN-115389697-A Method for synthesizing mixed type spontaneous combustion ionic liquid and determining ignition boundary 西安交通大学 2022-11-25 CN claimed
EP-0528214-B1 Process for the preparation of heterofullerenes and fullerenes KEESMANN TILL (DE) 1997-01-22 EP claimed
US-20250333782-A1 COMPOSITIONS INCLUDING AQUEOUS AMINE BORANE COMPLEXES AND POLYNUCLEOTIDES, AND METHODS OF USING THE SAME TO DETECT METHYLCYTOSINE OR HYDROXYMETHYLCYTOSINE ILLUMINA INC (US) 2025-10-30 US disclosed
EP-4499859-A1 COMPOSITIONS INCLUDING AQUEOUS AMINE BORANE COMPLEXES AND POLYNUCLEOTIDES, AND METHODS OF USING THE SAME TO DETECT METHYLCYTOSINE OR HYDROXYMETHYLCYTOSINE Illumina, Inc. (US) 2025-02-05 EP disclosed
CN-115389697-B Mixed spontaneous combustion ionic liquid synthesis and ignition boundary determination method 西安交通大学 2024-09-06 CN disclosed
CN-118515699-A Hirsutine alkaloid boric acid derivative and preparation method and application thereof 中国海洋大学 2024-08-20 CN disclosed
WO-2024130031-A1 BORANES ON SOLID SUPPORTS ILLUMINA, INC. (US) 2024-06-20 WO disclosed
WO-2023187012-A1 COMPOSITIONS INCLUDING AQUEOUS AMINE BORANE COMPLEXES AND POLYNUCLEOTIDES, AND METHODS OF USING THE SAME TO DETECT METHYLCYTOSINE OR HYDROXYMETHYLCYTOSINE ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-05 WO disclosed
CN-110214135-B Indanyl amino pyrazinyl cyclopropane carboxylic acid, pharmaceutical composition and application thereof 勃林格殷格翰国际有限公司 2023-02-21 CN disclosed
CN-115389697-A Method for synthesizing mixed type spontaneous combustion ionic liquid and determining ignition boundary 西安交通大学 2022-11-25 CN disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed
EP-0528214-B1 Process for the preparation of heterofullerenes and fullerenes KEESMANN TILL (DE) 1997-01-22 EP disclosed