SCHEMBL7976279

SCHEMBL7976279

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
HTT P42858 1/20 0.37
RHOC P08134 1/20 0.37
RHOA P61586 1/20 0.37
CA3 P07451 2/20 0.36
CA5A P35218 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
EPHX1 P07099 1/20 0.35
NQO2 P16083 2/20 0.33

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
SCHEMBL8077587 0.89 HTT (0.39) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL7976286 0.84 HTT (0.40) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL7977739 0.84 RHOC (0.51) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL8062091 0.84 RHOC (0.59) RHOCRHOACA2CA7CA9
SCHEMBL4045393 0.83 CA12 (0.45) MEN1KMT2AHTTCA12CA2
SCHEMBL8065652 0.82 TRPV1 (0.51) RHOCRHOACA2CA7CA9
SCHEMBL8065554 0.81 HTT (0.36) ALDH1A1SMN1; SMN2MEN1KMT2AHTT
SCHEMBL8065667 0.81 NPC1 (0.42) ALDH1A1SMN1; SMN2POLBKMT2AHTT
SCHEMBL7982289 0.81 HDAC1 (0.45) ALDH1A1HTTRHOCRHOAHPGD
SCHEMBL8077400 0.81 MAPT (0.47) ALDH1A1SMN1; SMN2POLBMEN1KMT2A

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