SCHEMBL8631007

SCHEMBL8631007

FC(F)(F)c1cc(NCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc(C(F)(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHOC P08134 3/20 0.38
RHOA P61586 3/20 0.38
P2RX1 P51575 3/20 0.34
HTT P42858 1/20 0.33
P2RX4 Q99571 1/20 0.33
P2RX7 Q99572 1/20 0.33
TMPRSS4 Q9NRS4 1/20 0.33
JUN P05412 3/20 0.32
NFKB1 P19838 3/20 0.32
NFKB2 Q00653 3/20 0.32
RELA Q04206 3/20 0.32
SCN9A Q15858 1/20 0.31
SLC13A3 Q8WWT9 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.30
XPO1 O14980 1/20 0.30
ATF1 P18846 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8408424 0.90 HTT (0.38) RHOCRHOAHTTSCN9AALDH1A1
SCHEMBL8659999 0.87 HTT (0.37) RHOCRHOAHTTSCN9A
SCHEMBL7982287 0.85 HDAC1 (0.36) HTTALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL8062091 0.84 RHOC (0.59) RHOCRHOASCN9AMRGPRX4
SCHEMBL7965854 0.84 HTT (0.35) RHOCRHOAHTTSCN9A
SCHEMBL7979390 0.83 SCN8A (0.38) RHOCRHOAHTTSCN9A
SCHEMBL7979279 0.83 MAPT (0.36) RHOCRHOAHTTSCN9AALDH1A1
SCHEMBL7073001 0.83 PRKAB2 (0.38) RHOCRHOAALDH1A1LMNAHPGD
SCHEMBL7965745 0.83 MAPT (0.35) RHOCRHOAHTTSCN9AALDH1A1
SCHEMBL8659785 0.82 PLAU (0.39) HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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