SCHEMBL376975

SCHEMBL376975

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

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
Bronopol SCHEMBL2680265 0.85 LMNA (0.65)
SCHEMBL1702973 0.82
SCHEMBL6343599 0.77
SCHEMBL27913854 0.77 ALDH1A1 (0.34)
SCHEMBL1703572 0.77 TSHR (0.42)
SCHEMBL28160824 0.72
SCHEMBL3273563 0.72
SCHEMBL1700913 0.72 ALDH1A1 (0.43)
SCHEMBL8060213 0.70
SCHEMBL899692 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 432 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112315862-A Preparation method of blackhead guiding-out liquid bamboo charcoal blackhead absorbing nasal membrane 广州市古得化妆品有限公司 2021-02-05 CN claimed
CN-111053732-A A cream-gel 上海通用药业股份有限公司 2020-04-24 CN claimed
CN-110960483-A A method for preparing cream-gel 上海通用药业股份有限公司 2020-04-07 CN claimed
US-20190223434-A1 COMPOSITIONS AND METHODS FOR BIOFILM REMOVAL HARBISON-FISCHER, INC. 2019-07-25 US claimed
US-20170190956-A1 AQUEOUS EMULSIONS FOR CROSSLINKING KMP Holdings, LLC (US) 2017-07-06 US claimed
WO-2015123397-A1 AQUEOUS EMULSIONS FOR CROSSLINKING BEACH SEAN (US) 2015-08-20 WO claimed
US-8999399-B2 Combined disinfection and decontamination agent having increased effectiveness Bose Chemie GmbH (DE) 2015-04-07 US claimed
US-8303821-B2 Reduction of antimicrobial compound levels during product dispensing ROHM AND HAAS COMPANY (US) 2012-11-06 US claimed
US-20120107415-A1 COMBINED DISINFECTION AND DECONTAMINATION AGENT HAVING INCREASED EFFECTIVENESS MULTIBIND BIOTEC GMBH (DE) 2012-05-03 US claimed
EP-2243516-B1 Reduction of antimicrobial compound levels during product dispensing ROHM & HAAS (US) 2011-10-26 EP claimed
US-5292763-A Synergistic microbicidal combinations containing 4,5-dichloro-2-octyl-3-isothiazolone and certain commercial biocides ROHM AND HAAS COMPANY (US) 1994-03-08 US claimed
EP-0445924-B1 PHENOTHRIN SHAMPOO Euroceltique S.A. (LU) 1993-09-29 EP claimed
US-5236888-A Synergistic ROHM AND HAAS COMPANY (US) 1993-08-17 US claimed
EP-0490567-A1 The use of halogen-containing organic stabilizers for 3-isothiazolones ROHM AND HAAS COMPANY (US) 1992-06-17 EP claimed
EP-0490570-A2 Microbicidal compositions containing 4,5-dichloro-2-cyclohexyl-3-isothiazolone and 3-iodo-2-propynylbutylcarbamate ROHM AND HAAS COMPANY (US) 1992-06-17 EP claimed
US-5026491-A Isothiazolone and biocide ROHM AND HAAS COMPANY (US) 1991-06-25 US claimed
EP-0431752-A2 Synergistic microbicidal combinations ROHM AND HAAS COMPANY (US) 1991-06-12 EP claimed
EP-0375367-A2 Biocidal compositions ROHM AND HAAS COMPANY (US) 1990-06-27 EP claimed
US-4764527-A Hydroxypyrazole derivatives, composition containing them and their use against microorganisms BASF AKTIENGESELLSCHAFT (DE) 1988-08-16 US claimed
US-4326977-A Liquid antiseptic cleaners with improved foaming properties BASF WYANDOTTE CORPORATION (US) 1982-04-27 US claimed