SCHEMBL524958

SCHEMBL524958

CC(N)[n+]1ccccc1

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 SCHEMBL28936676 0.97 ALDH1A1 (0.34)
SCHEMBL5176797 0.73 ALDH1A1 (0.38)
SCHEMBL98364 0.73
SCHEMBL10066918 0.73
SCHEMBL30272404 0.71 ALDH1A1 (0.32)
Bromide SCHEMBL17335765 0.71 ALDH1A1 (0.36)
Iodide SCHEMBL4435737 0.71 ALDH1A1 (0.32)
Hydrochloric Acid SCHEMBL3908734 0.71 ALDH1A1 (0.32)
SCHEMBL266061 0.69
SCHEMBL5455473 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107630385-B Microfibrous cellulose aggregate, process for producing same, and process for remanufacturing microfibrous cellulose dispersion 王子控股株式会社 2020-12-11 CN disclosed
CN-110062771-A Polymer, resin composition, antifouling coating composition, method for producing polymer, method for forming structure for stabilizing urethane on coating film surface, and method for regenerating structure for stabilizing urethane on coating film surface 学校法人早稻田大学 2019-07-26 CN disclosed
EP-2346528-B1 NICOTINE IMMUNONANOTHERAPEUTICS MASSACHUSETTS INST TECHNOLOGY (US) 2016-04-06 EP disclosed
US-8932595-B2 Nicotine immunonanotherapeutics MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-01-13 US disclosed
US-8591905-B2 Nicotine immunonanotherapeutics THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2013-11-26 US disclosed
CN-103298861-A Process for production of finely fibrous cellulose composite prepreg sheet, process for production of finely fibrous cellulose composite sheet, and process for production of finely fibrous cellulose composite laminate sheet OJI HOLDINGS CORP 2013-09-11 CN disclosed
US-20130142821-A1 Hapten-Carrier Conjugates and Uses Thereof CYTOS BIOTECHNOLOGY AG (CH) 2013-06-06 US disclosed
US-8187607-B2 Hapten-carrier conjugates and uses thereof CYTOS BIOTECHNOLOGY AG (CH) 2012-05-29 US disclosed
US-20120027808-A1 NICOTINE IMMUNONANOTHERAPEUTICS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2012-02-02 US disclosed
EP-2392345-A2 Hapten-carrier conjugates comprising virus like particles and uses thereof Cytos Biotechnology AG (CH) 2011-12-07 EP disclosed
US-20080255152-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY 2008-10-16 US disclosed
US-7381719-B2 Diaryl ethers as opioid receptor antagonist ELI LILLY AND COMPANY (US) 2008-06-03 US disclosed
US-20060217372-A1 Diaryl ethers as opioid receptor antagonist ELI LILLY AND COMPANY 2006-09-28 US disclosed
US-20050281845-A1 Hapten-carrier conjugates and uses thereof CYTOS BIOTECHNOLOGY AG (CH) 2005-12-22 US disclosed
US-6932971-B2 Hapten-carrier conjugates and uses thereof CYTOS BIOTECHNOLOGY AG (CH) 2005-08-23 US disclosed
EP-1562595-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-08-17 EP disclosed
EP-1523334-A2 HAPTEN-CARRIER CONJUGATES AND USES THEREOF Cytos Biotechnology AG (CH) 2005-04-20 EP disclosed
WO-2004026305-A1 DIARYL ETHERS AS OPIOID RECEPTOR ANTAGONIST ELI LILLY AND COMPANY (US) 2004-04-01 WO disclosed
US-20040059094-A1 Hapten-carrier conjugates and uses thereof CYTOS BIOTECHNOLOGY AG (CH) 2004-03-25 US disclosed
WO-2004009116-A2 HAPTEN-CARRIER CONJUGATES COMPRISING VIRUS LIKE PARTICLES AND USES THEREOF CYTOS BIOTECHNOLOGY AG (CH) 2004-01-29 WO disclosed