SCHEMBL7977839

SCHEMBL7977839

CC(C)N(CCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
HSD11B1 P28845 1/20 0.31

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
SCHEMBL7979491 0.87 CYP11B1 (0.32) PTGDR2NR1H2NR1H3
SCHEMBL7965820 0.84 CYP11B1 (0.33) PTGDR2NR1H2NR1H3
SCHEMBL7977841 0.83 CYP11B1 (0.36) APP
SCHEMBL8405597 0.82 MAOB (0.39)
SCHEMBL8408473 0.81 HTT (0.35) PTGDR2NR1H2NR1H3
SCHEMBL8405535 0.80 PPARA (0.39)
SCHEMBL7979492 0.80 BCHE (0.43)
SCHEMBL8655461 0.79 HDAC1 (0.36)
SCHEMBL8659996 0.78 FFAR1 (0.36)
SCHEMBL8659999 0.78 HTT (0.37)

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 2 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-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-02-25 EP disclosed