SCHEMBL7977795

SCHEMBL7977795

O=C(NCCCCOc1c(Br)cc(OCC=C(Cl)Cl)cc1Br)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHOC P08134 2/20 0.45
RHOA P61586 2/20 0.45
NAMPT P43490 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
EPHX2 P34913 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TBK1 Q9UHD2 1/20 0.39
PPARD Q03181 2/20 0.39
HPGD P15428 2/20 0.38
HDAC3 O15379 2/20 0.38
HDAC1 Q13547 2/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL7979250 0.97 RHOC (0.48) RHOCRHOANAMPTCA1CA2
SCHEMBL8060846 0.90 RHOC (0.47) RHOCRHOANAMPTCA1CA2
SCHEMBL7981953 0.89 RHOC (0.44) RHOCRHOANAMPTEPHX2NPC1
SCHEMBL7982256 0.89 HDAC3 (0.46) RHOCRHOANAMPTNPC1RAB9A
SCHEMBL7976163 0.89 SCN9A (0.43) RHOCRHOAPPARD
SCHEMBL7975921 0.88 RHOC (0.44) RHOCRHOANAMPTEPHX2NPC1
SCHEMBL7977739 0.87 RHOC (0.51) RHOCRHOANAMPTCA1CA2
SCHEMBL7982122 0.87 RHOC (0.45) RHOCRHOANAMPTCA1CA2
SCHEMBL7979570 0.86 RHOC (0.47) RHOCRHOAEPHX2NPC1RAB9A
SCHEMBL7976125 0.86 RHOC (0.44) RHOCRHOANAMPTCA1CA2

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