SCHEMBL57179

SCHEMBL57179

Nc1ccc(Br)cc1F

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
Bromide SCHEMBL9352122 0.97 ALDH1A1 (0.54)
Hydrochloric Acid SCHEMBL27652041 0.97 ALDH1A1 (0.54)
Sulfuric Acid SCHEMBL28433502 0.87 CA12 (0.50)
SCHEMBL109380 0.79
SCHEMBL29849481 0.79
SCHEMBL28871014 0.76 ALDH1A1 (0.48)
SCHEMBL29388695 0.75
SCHEMBL29394596 0.75
SCHEMBL505542 0.75
SCHEMBL13663 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

Appears in 2856 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215126-A1 SYNTHESIS OF VIDOFLUDIMUS AND ITS CALCIUM SALT IMMUNIC AG (DE) 2025-10-16 WO claimed
CN-119798252-A Method for preparing N-ortho-acyl substituted nitrogen-containing heterocyclic compound and amine-shrinking iron (II) complex thereof 中国石油化工股份有限公司 2025-04-11 CN claimed
CN-119707773-A Preparation method and application of maleimide structure-containing compound 中国农业大学 2025-03-28 CN claimed
CN-119143751-A N-ortho-acyl substituted nitrogen-containing heterocyclic compound and preparation method of amine-shrinking iron (II) complex thereof 中国石油化工股份有限公司 2024-12-17 CN claimed
CN-116102397-B Flurbiprofen Process for the preparation of a compound containing a compound selected from the group consisting of 沈阳药科大学 2024-08-30 CN claimed
CN-114544785-B Flurbiprofen and detection method of impurities thereof 远大生命科学(鞍山)有限公司 2024-06-21 CN claimed
US-20240150317-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2024-05-09 US claimed
CN-117924207-A Epoxy resin flexible film with high glass transition temperature 中国科学院深圳先进技术研究院 2024-04-26 CN claimed
CN-117658763-A Preparation method of 5-bromo-1, 2-dichloro-3-fluorobenzene 棓诺(苏州)新材料有限公司 2024-03-08 CN claimed
CN-114907261-B 2-phenylaminoquinoline derivative, preparation method and application thereof 湖南中医药大学 2023-10-27 CN claimed
WO-2005026150-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 WO claimed
WO-2005026157-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-03-24 WO claimed
WO-2005007642-A2 NOVEL AZAHETEROCYCLIC AMIDES USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2005-01-27 WO claimed
EP-0514472-B1 HALOGENATION OF AROMATIC AMINE COMPOUNDS MALLINCKRODT INC (US) 1994-09-28 EP claimed
WO-1993019026-A1 PREPARATION OF 3-HALO-HALOBENZENES AND 1-HALO-3,5-DIHALOBENZENES MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1993-09-30 WO claimed
EP-0514472-A1 HALOGENATION OF AROMATIC AMINE COMPOUNDS. MALLINCKRODT INC (US) 1992-11-25 EP claimed
US-5157169-A Preparation of 3-halo-halobenzenes and 1-halo-3,5-dihalobenzenes MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1992-10-20 US claimed
US-5053542-A Quaternary ammonium halide MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1991-10-01 US claimed
WO-1991011430-A1 HALOGENATION OF AROMATIC AMINE COMPOUNDS MALLINCKRODT, INC. (US) 1991-08-08 WO claimed
US-4443631-A DIMETHYLFORMAMIDE OR DIMETHYLACETAMIDE SOLVENT 2-(2-FLUORO-4-BIPHENYLYL)PROPIONIC ACID INTERMEDIATE THE UPJOHN COMPANY (US) 1984-04-17 US claimed