SCHEMBL7982192

SCHEMBL7982192

O=C(NCCCOc1c(Br)cc(OCC=C(Cl)Cl)cc1Br)c1ccc(C(F)(F)F)cn1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 16/20 0.46
SCN10A Q9Y5Y9 3/20 0.41
PPARD Q03181 2/20 0.41
RHOC P08134 1/20 0.41
RHOA P61586 1/20 0.41
PRKAB2 O43741 1/20 0.38
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAG3 Q9UGI9 1/20 0.38
PRKAG2 Q9UGJ0 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38
SCN7A Q01118 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN5A Q14524 1/20 0.38

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
SCHEMBL7976163 0.97 SCN9A (0.43) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7965974 0.91 SCN9A (0.46) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7979521 0.90 SCN9A (0.47) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7977745 0.89 SCN9A (0.47) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7979250 0.88 RHOC (0.48) PPARDRHOCRHOA
SCHEMBL7976376 0.88 SCN9A (0.43) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7976090 0.87 SCN9A (0.44) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7979404 0.87 SCN9A (0.45) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7977981 0.87 SCN9A (0.45) SCN9ASCN10APPARDRHOCRHOA
SCHEMBL7979538 0.86 SCN9A (0.44) SCN9ASCN10APPARDRHOCRHOA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
EP-0824514-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2000-09-06 EP disclosed
US-6028100-A Dihalopropene compounds, insecticides containing them as active ingredients, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-22 US disclosed
US-5952386-A EXCELLENT INSECTICIDAL ACTIVITY FOR THE CONTROL OF NOXIOUS INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-14 US disclosed