SCHEMBL7979244

SCHEMBL7979244

O=C(CCCNC(=O)c1ccc(C(F)(F)F)cc1F)Oc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
RHOC P08134 1/20 0.36
RHOA P61586 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
PPARD Q03181 12/20 0.36
PPARA Q07869 8/20 0.35
PPARG P37231 5/20 0.35
MRGPRX4 Q96LA9 2/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL7979400 0.91 FLT1 (0.37) GAAMAPTHTTRHOCRHOA
SCHEMBL7976381 0.91 HDAC1 (0.42) GAAMAPTHTTRHOCRHOA
SCHEMBL8602862 0.89 RHOC (0.40) HTTRHOCRHOACYP11B1CYP11B2
SCHEMBL7979282 0.89 RHOC (0.42) GAAMAPTHTTRHOCRHOA
SCHEMBL7977813 0.89 FOLH1 (0.40) MAPTHDAC1
SCHEMBL7965923 0.88 MAPT (0.46) GAAMAPTHTT
SCHEMBL7979241 0.86 MAPT (0.37) GAAMAPTHTTCYP11B1CYP11B2
SCHEMBL7982372 0.82 PPARD (0.44) RHOCRHOAPPARDPPARAPPARG
SCHEMBL7976379 0.82 HDAC1 (0.39) MAPTHDAC1
SCHEMBL7977673 0.81 KMT2A (0.45) MAPTHTT

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 5 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
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