SCHEMBL314880

SCHEMBL314880

C/C=[C]/c1ccccc1

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
SCHEMBL8573748 1.00
SCHEMBL123465 1.00
SCHEMBL5574099 0.75 APP (0.50)
SCHEMBL1609637 0.74 ALDH1A1 (0.48)
SCHEMBL29080003 0.72 GRM5 (0.50)
SCHEMBL13268699 0.72 CA12 (0.46)
SCHEMBL8051285 0.72
SCHEMBL18148663 0.72 APP (0.41)
SCHEMBL18148662 0.72 APP (0.41)
SCHEMBL4343899 0.72 APP (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084910-A Bridged ring imine benzo aza Zhuo Chou triazoline quinazoline compound and synthetic method and application thereof 江苏师范大学 2024-05-28 CN claimed
CN-115745808-B Method for preparing secondary amine compound by catalyzing reduction of imine compound 延安大学 2024-04-30 CN claimed
CN-117886839-A Organic semiconductor luminescent compound and application thereof 冠能光电材料(深圳)有限责任公司 2024-04-16 CN claimed
CN-116874377-A Method for preparing aromatic primary amine by catalytic reduction of nitroaromatic hydrocarbon by silver trifluoromethane sulfonate 延安大学 2023-10-13 CN claimed
CN-116850962-A Modified graphene oxide material, preparation method thereof and application thereof in metal ore selection 山东理工大学 2023-10-10 CN claimed
CN-112824425-B 6-alkenyl substituted cholic acid compound and preparation method and application thereof 成都西岭源药业有限公司 2023-10-03 CN claimed
CN-116535460-A Sulfur-containing peptidomimetic compounds, and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2023-08-04 CN claimed
CN-113929797-B Solid catalyst component and catalyst system for producing polymers 中国石油化工股份有限公司 2023-07-21 CN claimed
CN-114085301-B Solid catalyst component for preparing olefin polymer and application thereof 中国石油化工股份有限公司 2023-05-09 CN claimed
CN-116082817-A Resin composition and product made therefrom 台光电子材料(昆山)有限公司 2023-05-09 CN claimed
WO-1993002057-A1 RETROVIRAL PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-02-04 WO claimed
WO-1992020663-A1 SUBSTITUTED TRIAZOLINONES BAYER AKTIENGESELLSCHAFT (DE) 1992-11-26 WO claimed
EP-0511569-A1 Substituted triazolinone BAYER AG (DE) 1992-11-04 EP claimed
EP-0502307-A2 Substituted 4,5-diamino-1,2,4-triazol-3-(thi)ones BAYER AG (DE) 1992-09-09 EP claimed
WO-1992012130-A1 PIPERIDINE DERIVATIVES SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1992-07-23 WO claimed
EP-0494717-A1 Piperidine derivatives SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1992-07-15 EP claimed
EP-0056189-B1 2,3-BUTANEDIOL DIESTER DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND AN ANTIULCER DRUG CONTAINING THE SAME SS PHARMACEUTICAL CO., LTD. (JP) 1986-08-20 EP claimed
US-4599335-A FUNGICIDES, BACTERICIDES BASF AKTIENGESELLSCHAFT (DE) 1986-07-08 US claimed
US-4557865-A Substituted 4-azatricyclo[4.3.1.13,8 ]undecane compounds PENNWALT CORPORATION (US) 1985-12-10 US claimed
US-4410730-A Process for the production of o-(N-monosubstituted amino)benzyl alcohols SHIONOGI & CO., LTD. (JP) 1983-10-18 US claimed