SCHEMBL4451878

SCHEMBL4451878

[CH2]C([CH2])(CC)[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
SCHEMBL4104466 0.79 TSHR (0.42)
SCHEMBL19210077 0.74
SCHEMBL22443377 0.72
SCHEMBL15798180 0.71
SCHEMBL9452595 0.69 TSHR (0.44)
SCHEMBL9497771 0.69 ALDH1A1 (0.47)
SCHEMBL15798313 0.69
SCHEMBL67858 0.67
SCHEMBL1720481 0.67
SCHEMBL2271690 0.67 TSHR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2931768-B1 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ANGUS CHEMICAL (US) 2017-08-16 EP claimed
US-9676957-B2 Nitrofunctional acrylate copolymers for binder compositions ANGUS CHEMICAL COMPANY (US) 2017-06-13 US claimed
US-9670134-B2 Synthesis of (2-nitro)alkyl (meth)acrylates via transesterification of (meth)acrylate esters ANGUS CHEMICAL COMPANY (US) 2017-06-06 US claimed
US-20160046558-A1 SYNTHESIS OF (2-NITRO)ALKYL (METH)ACRYLATES VIA TRANSESTERIFICATION OF (METH)ACRYLATE ESTERS ADVANCION CORPORATION 2016-02-18 US claimed
US-20150322281-A1 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ADVANCION CORPORATION 2015-11-12 US claimed
EP-2931768-A1 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ANGUS Chemical Company (US) 2015-10-21 EP claimed
WO-2014158445-A1 SYNTHESIS OF (2-NITRO)ALKYL (METH)ACRYLATES VIA TRANSESTERIFICATION OF (METH)ACRYLATE ESTERS ROHM AND HAAS COMPANY (US) 2014-10-02 WO claimed
WO-2014092914-A1 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ANGUS CHEMICAL COMPANY (US) 2014-06-19 WO claimed
EP-0226612-B1 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES ROSSMOORE HAROLD W (US) 1994-07-13 EP claimed
EP-0226612-A4 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES. UNIV WAYNE STATE (US) 1990-04-10 EP claimed
EP-0226612-A1 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES. UNIV WAYNE STATE (US) 1987-07-01 EP claimed
WO-1986006403-A1 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) 1986-11-06 WO claimed
WO-2020012792-A1 WATER-SOLUBLE OIL COMPOSITION FOR METALWORKING 株式会社ネオス 2020-01-16 WO disclosed
US-9676957-B2 Nitrofunctional acrylate copolymers for binder compositions ANGUS CHEMICAL COMPANY (US) 2017-06-13 US disclosed
US-9670134-B2 Synthesis of (2-nitro)alkyl (meth)acrylates via transesterification of (meth)acrylate esters ANGUS CHEMICAL COMPANY (US) 2017-06-06 US disclosed
EP-3121206-A2 NITROFUNCTIONAL ACRYLATE COPOLYMERS FOR BINDER COMPOSITIONS ANGUS Chemical Company (US) 2017-01-25 EP disclosed
US-5053081-A Rinsing to enhance siccative adhesion coating; corrosion resistance; chromins free OAKITE PRODUCTS, INC. (US) 1991-10-01 US disclosed
EP-0226612-A4 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES. UNIV WAYNE STATE (US) 1990-04-10 EP disclosed
EP-0226612-A1 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES. UNIV WAYNE STATE (US) 1987-07-01 EP disclosed
WO-1986006403-A1 SYNERGISTIC ANTIMICROBIAL OR BIOCIDAL MIXTURES BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) 1986-11-06 WO disclosed