SCHEMBL8225902

SCHEMBL8225902

CC=CC(=O)OC1C=CC([N+](=O)[O-])=CC1(CCCCCCCC)[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNTT P04053 2/20 0.33
POLB P06746 1/20 0.33
POLA1 P09884 1/20 0.33
MGLL Q99685 1/20 0.30
CACNA1F O60840 1/20 0.30
CACNA1D Q01668 1/20 0.30
CACNA1S Q13698 1/20 0.30
CACNA1C Q13936 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL8225898 1.00 DNTT (0.33) DNTTPOLBPOLA1MGLLCACNA1F
SCHEMBL4390350 0.76
SCHEMBL31532976 0.66
SCHEMBL8384100 0.59 CACNA1F (0.30) CACNA1FCACNA1DCACNA1SCACNA1C
SCHEMBL906661 0.58 THRB (0.44)
SCHEMBL10426611 0.58
SCHEMBL1858016 0.57 THRA (0.38) POLBMGLL
SCHEMBL8029495 0.54 HCAR2 (0.70)
SCHEMBL5176603 0.54 HCAR2 (0.70)
SCHEMBL1067418 0.54 HCAR2 (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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051070-A1 WATER-DISPERSIBLE FLAKE COMPOSITIONS ZENECA LIMITED (GB) 2000-11-15 EP disclosed
WO-1999039577-A1 WATER-DISPERSIBLE FLAKE COMPOSITIONS ZENECA LIMITED (GB) 1999-08-12 WO disclosed
US-5332584-A Microcapsules ZENECA INC. (US) 1994-07-26 US disclosed
EP-0571396-A1 MICROCAPSULES AND MICROENCAPSULATION PROCESS. ZENECA INC (US) 1993-12-01 EP disclosed
US-5160529-A Anilide herbicide, etherified amino resin IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-11-03 US disclosed
WO-1992013448-A1 MICROCAPSULES AND MICROENCAPSULATION PROCESS ZENECA INC. (US) 1992-08-20 WO disclosed
US-5120542-A Protective device for pyrethroid compounds consist of nonionic surfactant polyether to reduce dermal toxicity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-06-09 US disclosed
US-4994261-A Organophosphorus pesticide safened for handling by including nonionic surfactant and dry inert diluent carrier ICI AMERICAS INC. (US) 1991-02-19 US disclosed
US-4956129-A Microencapsulation process ICI AMERICAS INC. (US) 1990-09-11 US disclosed
US-4933167-A MICROENCAPSULATED PESTICIDE, SURFACTANT, WATER; LOWERED DERMAL TOXICITY SYNGENTA CROP PROTECTION, INC. 1990-06-12 US disclosed
EP-0134674-B1 PESTICIDE COMPOSITIONS STAUFFER CHEMICAL COMPANY (US) 1988-09-14 EP disclosed
EP-0158449-B1 MICROCAPSULES AND MICROENCAPSULATION PROCESS STAUFFER CHEMICAL COMPANY (US) 1987-11-04 EP disclosed
EP-0243694-A2 Pesticide compositions and method STAUFFER CHEMICAL COMPANY (US) 1987-11-04 EP disclosed
EP-0134674-A1 Pesticide compositions STAUFFER CHEMICAL COMPANY (US) 1985-03-20 EP disclosed
US-4456569-A FORMING PROTECTIVE COLLOID USING GRAFT COPOLYMER OF POLYVINYL ALCOHOL AND METHYL VINYL ETHER-MALEIC ACID STAUFFER CHEMICAL COMPANY (US) 1984-06-26 US disclosed
US-4448929-A PROTECTIVE COLLOID FOR INTERFACIAL POLYMERIZATION STAUFFER CHEMICAL COMPANY (US) 1984-05-15 US disclosed