SCHEMBL7184575

SCHEMBL7184575

CC=CC(=O)Oc1cccc(C([N+](=O)[O-])[N+](=O)[O-])c1CCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.42
THRB P10828 2/20 0.42
PPARG P37231 3/20 0.37
PPARA Q07869 2/20 0.37
POLM Q9NP87 2/20 0.35
POLK Q9UBT6 2/20 0.35
POLL Q9UGP5 2/20 0.35
POLH Q9Y253 2/20 0.35
SLC2A1 P11166 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.34
CNR1 P21554 4/20 0.33
CNR2 P34972 4/20 0.33
NCEH1 Q6PIU2 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL10922267 0.81 THRB (0.49) THRATHRBPPARGPPARAPOLM
SCHEMBL10922268 0.81 THRB (0.49) THRATHRBPPARGPPARAPOLM
SCHEMBL7184564 0.77 PPARG (0.40) THRATHRBPPARGPPARAPOLM
SCHEMBL7184571 0.77 PPARG (0.40) THRATHRBPPARGPPARAPOLM
SCHEMBL27303606 0.77 THRA (0.38) THRATHRB
SCHEMBL1858016 0.77 THRA (0.38) THRATHRB
SCHEMBL5297327 0.74 THRA (0.73) THRATHRBPPARGPPARAZDHHC2
SCHEMBL5297313 0.74 THRA (0.73) THRATHRBPPARGPPARAZDHHC2
SCHEMBL8522279 0.74 THRA (0.73) THRATHRBPPARGPPARAZDHHC2
SCHEMBL8522277 0.74 THRA (0.73) THRATHRBPPARGPPARAZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0942651-B1 INSECTICIDAL AND MITICIDAL COMPOSITIONS BASF AG (DE) 2003-04-23 EP claimed
US-6337345-B1 CHLORFENAPYR AND FORMAMIDINE INSECTICIDE AMERICAN CYANAMID CO. 2002-01-08 US claimed
EP-0942651-A1 INSECTICIDAL AND MITICIDAL COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1999-09-22 EP claimed
WO-1998023154-A1 INSECTICIDAL AND MITICIDAL COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1998-06-04 WO claimed
EP-0257845-B1 METHOD OF PRODUCING VARIEGATED PLANTS Taguchi, Masayasu (JP) 1991-10-16 EP claimed
EP-0257845-A2 Method of producing variegated plants Taguchi, Masayasu (JP) 1988-03-02 EP claimed
JP-10158103-A None JP disclosed
EP-0942651-B1 INSECTICIDAL AND MITICIDAL COMPOSITIONS BASF AG (DE) 2003-04-23 EP disclosed
EP-0942651-B1 INSECTICIDAL AND MITICIDAL COMPOSITIONS BASF AG (DE) 2003-04-23 EP disclosed
CN-1105497-C Insecticidal and miticidal compositions AMERICAN CYANAMID CO (US) 2003-04-16 CN disclosed
US-6337345-B1 CHLORFENAPYR AND FORMAMIDINE INSECTICIDE AMERICAN CYANAMID CO. 2002-01-08 US disclosed
US-6337345-B1 CHLORFENAPYR AND FORMAMIDINE INSECTICIDE AMERICAN CYANAMID CO. 2002-01-08 US disclosed
CN-1238662-A Insecticidal and miticidal compositions AMERICAN CYANAMID CO (US) 1999-12-15 CN disclosed
EP-0094082-B1 ISOXAZOLINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND INSECTICIDAL AND ACARICIDAL COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1986-03-26 EP disclosed
US-4562193-A 4-[2-(Di- or trisubstitutedphenoxy)ethyl amino]thienodipyrimidines and insecticidal and acaricidal composition containing said pyrimidines SANKYO COMPANY LIMITED (JP) 1985-12-31 US disclosed
EP-0057440-B1 AMINOPYRIMIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND FUNGICIDAL, INSECTICIDAL AND ACARICIDAL COMPOSITIONS CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1985-05-22 EP disclosed
US-4435402-A Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY, LIMITED (JP) 1984-03-06 US disclosed
EP-0094082-A1 Isoxazolinone derivatives, process for their preparation and insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1983-11-16 EP disclosed
EP-0057440-A1 Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1982-08-11 EP disclosed
US-4007267-A FROM STREPTOMYCES RIMOFACIENS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1977-02-08 US disclosed