SCHEMBL1887347

SCHEMBL1887347

C=CC[N+]([O-])(CC)CC

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
SCHEMBL460055 0.81 BBOX1 (0.30)
SCHEMBL28852757 0.78 TSHR (0.35)
SCHEMBL361435 0.75 TSHR (0.44)
SCHEMBL7287856 0.75 BBOX1 (0.33)
Hydrochloric Acid SCHEMBL23277158 0.73 KDM4E (0.47)
Bromide SCHEMBL11016656 0.73 TSHR (0.41)
SCHEMBL8820850 0.72
SCHEMBL3804019 0.72
SCHEMBL8421987 0.71 LSS (0.48)
SCHEMBL8421490 0.71 LSS (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102232107-B Natural heavy duty cleaners CLOROX CO 2013-08-07 CN claimed
CN-103224715-A Preparation method of double-acetyl-p-phenylenediamine bisazo compound SINOCHEM CORP 2013-07-31 CN claimed
CN-102232107-A Natural heavy duty cleaners CLOROX CO 2011-11-02 CN claimed
EP-2361299-A2 NATURAL HEAVY DUTY CLEANERS The Clorox Company (US) 2011-08-31 EP claimed
WO-2010027608-A2 NATURAL HEAVY DUTY CLEANERS THE CLOROX COMPANY (US) 2010-03-11 WO claimed
US-7618931-B1 Natural heavy duty cleaners THE CLOROX COMPANY (US) 2009-11-17 US claimed
US-4181633-A ANIONIC OR NONIONIC SURFACTANTS COLGATE-PALMOLIVE COMPANY (US) 1980-01-01 US claimed
CN-117730137-A Premix comprising alkyl polyglycoside for preparing liquid detergent formulations 巴斯夫欧洲公司 2024-03-19 CN disclosed
CN-117264703-A Long-lasting cleaning foam 艺康股份有限公司 2023-12-22 CN disclosed
CN-117264703-A Long-lasting cleaning foam 艺康股份有限公司 2023-12-22 CN disclosed
US-20220400671-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF VIROX TECHNOLOGIES INC. (CA) 2022-12-22 US disclosed
EP-4102971-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF Virox Technologies Inc. (CA) 2022-12-21 EP disclosed
WO-2021161148-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF VIROX TECHNOLOGIES INC. (CA) 2021-08-19 WO disclosed
US-5314917-A Contraceptives E. B. MICHAELS RESEARCH ASSOCIATES, INC. (US) 1994-05-24 US disclosed
EP-0576425-A1 METHOD FOR INACTIVATING ENVELOPED VIRUSES AND SPERM E.B. MICHAELS RESEARCH ASSOCIATES, INC. (US) 1994-01-05 EP disclosed
US-5244652-A Gelatin, amphoteric surfactant, alcohol, gum E. B. MICHAELS RESEARCH ASSOCIATES, INC. (US) 1993-09-14 US disclosed
WO-1992016182-A2 METHOD FOR INACTIVATING ENVELOPED VIRUSES AND SPERM E.B. MICHAELS RESEARCH ASSOCIATES, INC. (US) 1992-10-01 WO disclosed
WO-1992016201-A1 METHOD FOR INACTIVATING ENVELOPED VIRUSES AND SPERM E.B. MICHAELS RESEARCH ASSOCIATES, INC. (US) 1992-10-01 WO disclosed
US-4181633-A ANIONIC OR NONIONIC SURFACTANTS COLGATE-PALMOLIVE COMPANY (US) 1980-01-01 US disclosed
US-3985669-A Detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1976-10-12 US disclosed