SCHEMBL453062

SCHEMBL453062

[C]1N[CH]c2ccccc21

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
SCHEMBL1162619 0.65
SCHEMBL9629175 0.61
SCHEMBL9629177 0.61
SCHEMBL1725484 0.59 PARP1 (0.33)
SCHEMBL709852 0.57 MAPT (0.39)
SCHEMBL29767688 0.55 CYP2A6 (0.36)
SCHEMBL237481 0.55
SCHEMBL8776016 0.55 CYP2A6 (0.36)
SCHEMBL205284 0.55
SCHEMBL8058639 0.55 CYP2A6 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3449904-B1 EMULSIFIED COSMETIC SHINETSU CHEMICAL CO (JP) 2024-06-19 EP claimed
CN-115737477-B Whitening composition, whitening antiseptic composition and application thereof 广州美尔生物科技有限公司 2023-04-07 CN claimed
CN-109964357-B Nonaqueous electrolyte secondary battery 松下知识产权经营株式会社 2022-10-18 CN claimed
CN-114652656-A Toilet articles for animal and cleaning and sterilizing articles for animal 佛山市思怡诺生物科技有限公司 2022-06-24 CN claimed
CN-113813370-A Medicine for ankylosing spondylitis and preparation method thereof 上海强直医院有限公司 2021-12-21 CN claimed
CN-113476336-A Acne-removing composition and preparation method and application thereof 广州美尔生物科技有限公司 2021-10-08 CN claimed
CN-106620445-B Skin-care microemulsion gel and preparation method thereof 安徽安科余良卿药业有限公司 2020-01-03 CN claimed
US-9139748-B2 Photocurable ink composition for inkjet printing, and printed material SAKATA INX CORP. (JP) 2015-09-22 US claimed
CN-101652713-A Comprise by the photosensitive resin composition of the prepared polymkeric substance of macromonomer as alkali soluble resins LG CHEMICAL LTD KR 2010-02-17 CN claimed
CN-1201749-C Vaginal delivery of bisphosphonates UMD INC (US) 2005-05-18 CN claimed
CN-1171583-C Medical percutaneous preparation containing hydrophilic or salt form ��ʽ����̫ƽ�� 2004-10-20 CN claimed
CN-1461207-A Vaginal delivery of bisphosphonates UMD INC (US) 2003-12-10 CN claimed
CN-1329886-A Medical percutaneous preparation containing hydrophilic or salt form PACIFIC CO LTD (KR) 2002-01-09 CN claimed
US-5721329-A Lactone-modified diketene (meth)acrylate compound, a process for the preparation thereof, and a (co)polymer DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-24 US claimed
EP-3756789-B1 FILM-LIKE FIRING MATERIAL AND FILM-LIKE FIRING MATERIAL WITH SUPPORT SHEET LINTEC CORP (JP) 2026-05-20 EP disclosed
US-12630727-B2 Photocurable inkjet printing ink composition SAKATA INX CORPORATION (JP) 2026-05-19 US disclosed
US-12625430-B2 Colored photosensitive resin composition and mutilayer cured film prepared therefrom DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2026-05-12 US disclosed
EP-0934293-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1999-08-11 EP disclosed
US-5721329-A Lactone-modified diketene (meth)acrylate compound, a process for the preparation thereof, and a (co)polymer DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-24 US disclosed
WO-1998004537-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING DISEASES ASSOCIATED WITH TRYPTASE ACTIVITY ARRIS PHARMACEUTICAL CORPORATION (US) 1998-02-05 WO disclosed