SCHEMBL8062091

SCHEMBL8062091

O=C(NCCCOc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHOC P08134 6/20 0.59
RHOA P61586 6/20 0.59
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
MRGPRX4 Q96LA9 3/20 0.38
TACR1 P25103 2/20 0.36
TP53BP1 Q12888 1/20 0.36
SCN9A Q15858 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35

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
SCHEMBL7977739 0.92 RHOC (0.51) RHOCRHOACA1CA2CA7
SCHEMBL8060846 0.89 RHOC (0.47) RHOCRHOACA1CA2CA7
SCHEMBL7965856 0.86 RHOC (0.48) RHOCRHOACA1CA2CA7
SCHEMBL7979391 0.85 RHOC (0.47) RHOCRHOACA1CA2CA7
SCHEMBL7982289 0.85 HDAC1 (0.45) RHOCRHOAMRGPRX4SCN9AHDAC1
SCHEMBL8345273 0.85 RHOC (0.50) RHOCRHOACA1CA2CA7
SCHEMBL8766542 0.85 RHOC (0.50) RHOCRHOACA1CA2CA7
SCHEMBL7965974 0.84 SCN9A (0.46) RHOCRHOASCN9A
SCHEMBL8065652 0.84 TRPV1 (0.51) RHOCRHOACA1CA2CA7
SCHEMBL8631007 0.84 RHOC (0.38) RHOCRHOAMRGPRX4SCN9A

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
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