SCHEMBL133589

SCHEMBL133589

COc1cccc(I)c1

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
SCHEMBL29349442 1.00
Ammonia Solution, Strong SCHEMBL6118665 0.98 ACHE (0.54)
Bromide SCHEMBL3349496 0.98 ACHE (0.54)
Iodide SCHEMBL21177827 0.98 ACHE (0.54)
SCHEMBL28278770 0.91 CES2 (0.52)
SCHEMBL12547126 0.84
SCHEMBL22050352 0.82 APP (0.77)
SCHEMBL13960629 0.82 APP (0.69)
Acrylic Acid SCHEMBL28304089 0.82 CES2 (0.51)
1,3-Dimethoxybenzene SCHEMBL901285 0.81 ACHE (0.70)

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 1458 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536686-B Carborane modified phthalonitrile monomer, preparation method thereof and carborane modified phthalonitrile resin 宁波杭州湾新材料研究院 2025-03-18 CN claimed
CN-115368218-B Method for preparing 4-diaryl methyl substituted phenol compound 湖南理工学院 2024-01-02 CN claimed
CN-115650867-B Chiral rare earth supermolecule cage complex and preparation method and application thereof 黑龙江大学 2023-06-27 CN claimed
CN-115650867-A Chiral rare earth supramolecular cage complex and preparation method and application thereof 黑龙江大学 2023-01-31 CN claimed
CN-115536686-A Carborane modified phthalonitrile monomer, preparation method thereof and carborane modified phthalonitrile resin 宁波杭州湾新材料研究院 2022-12-30 CN claimed
CN-115368218-A Method for preparing 4-diaryl methyl substituted phenol compound 湖南理工学院 2022-11-22 CN claimed
CN-111715262-B Preparation of palladium-gold loaded nitrogen-rich carbon nitride photocatalyst and C-C bonding 重庆工商大学 2022-07-08 CN claimed
CN-113578395-A Pd/Fe-MOFs promote photocatalytic C-N and C-C bonding 重庆工商大学 2021-11-02 CN claimed
CN-109021003-B Preparation method of vinyl silicon/germanium/stannane derivative 华侨大学 2021-06-01 CN claimed
WO-2021096496-A1 METHODS FOR FORMING ARYL CARBON-NITROGEN BONDS USING LIGHT AND PHOTOREACTORS USEFUL FOR CONDUCTING SUCH REACTIONS COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2021-05-20 WO claimed
CN-106699786-B A kind of quaternary water solubility azepine Aza-BODIPY and synthetic method 天津大学 2019-04-16 CN claimed
CN-109320583-A A kind of dehydroabietic acid benzimidazole thioether class Hete rocyclic derivatives with anti-tumor activity and its preparation method and application 南京林业大学 2019-02-12 CN claimed
CN-107266410-A A kind of 8 epi puupehedione synthetic method 哈尔滨工业大学(威海) 2017-10-20 CN claimed
CN-106699786-A Quaternary ammonium salt type water-soluble Aza-BODIPY (Boron Dipyrromethene Dye) and synthesis method 天津大学 2017-05-24 CN claimed
CN-106083803-A A kind of synthetic method of marine natural products Puupehedione 哈尔滨工业大学(威海) 2016-11-09 CN claimed
CN-104817512-A Synthetic method of oxazoline medical intermediate compound LIU ZENGFENG 2015-08-05 CN claimed
CN-102304056-B 3-methyl-4-aryl-3-alkenyl-butyryl-pentafluoroaniline derivatives and preparation method thereof UNIV ZHEJIANG 2013-12-11 CN claimed
CN-102304056-A 3-methyl-4-aryl-3-alkenyl-butyryl-pentafluoroaniline derivatives and preparation method thereof UNIV ZHEJIANG 2012-01-04 CN claimed
EP-1963344-A1 ORGANOPHOSPHORIC DERIVATIVES USEFUL AS ANTI-PARASITIC AGENTS UNIVERSITEIT GENT (BE) 2008-09-03 EP claimed
WO-2007071453-A1 ORGANOPHOSPHORIC DERIVATIVES USEFUL AS ANTI-PARASITIC AGENTS UNIVERSITEIT GENT (BE) 2007-06-28 WO claimed