SCHEMBL7976271

SCHEMBL7976271

O=C(NCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
HTT P42858 3/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 6/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
ALDH1A1 P00352 4/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
RHOC P08134 1/20 0.39
RHOA P61586 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL7965923 0.90 MAPT (0.46) MAPTHTTGAALMNAMEN1
SCHEMBL7979282 0.87 RHOC (0.42) MAPTHTTGAASMN1; SMN2ALDH1A1
SCHEMBL7965747 0.87 RHOC (0.42) MAPTHTTGAAFLT1FLT4
SCHEMBL7982289 0.87 HDAC1 (0.45) MAPTHTTGAALMNAALDH1A1
SCHEMBL7976268 0.85 MAPT (0.56) MAPTHTTGAALMNAMEN1
SCHEMBL7977739 0.84 RHOC (0.51) MAPTHTTGAALMNAMEN1
SCHEMBL8060846 0.81 RHOC (0.47) MAPTHTTGAALMNAMEN1
SCHEMBL7965974 0.81 SCN9A (0.46) RHOCRHOAPPARD
SCHEMBL8065621 0.80 ALDH1A1 (0.47) MAPTHTTGAALMNAMEN1
SCHEMBL8062091 0.80 RHOC (0.59) RHOCRHOA

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 6 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
EP-0824514-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-02-25 EP disclosed
WO-1996033160-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-24 WO disclosed