SCHEMBL7965858

SCHEMBL7965858

CCc1cc(OCC=C(Br)Br)cc(C)c1OCCCCCN

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.34
THRB P10828 3/20 0.34
F2 P00734 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
PLA2G2A P14555 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SUCNR1 Q9BXA5 2/20 0.30
ITGB3 P05106 1/20 0.30
ITGA2B P08514 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL8063193 0.99 KDM4E (0.34) THRATHRBF2KDM4EALDH1A1
SCHEMBL7981988 0.95 KDM4E (0.32) THRATHRBKDM4EALDH1A1MEN1
SCHEMBL7979323 0.91 PLAU (0.36) KDM4EALDH1A1MEN1CYP1A2CYP2D6
SCHEMBL7982158 0.90 KDM4E (0.37) THRATHRBF2KDM4EALDH1A1
SCHEMBL7979192 0.89 KDM4E (0.38) THRATHRBF2KDM4EALDH1A1
SCHEMBL7978996 0.88 HTT (0.34) THRATHRBF2PLA2G2ASUCNR1
SCHEMBL8405671 0.88 KDM4E (0.34) THRATHRBKDM4EALDH1A1MEN1
SCHEMBL8409064 0.88 KDM4E (0.34) THRATHRBKDM4EALDH1A1MEN1
SCHEMBL7977565 0.87 HTT (0.35) THRATHRBF2KDM4EALDH1A1
SCHEMBL8407472 0.86 KDM4E (0.33) THRATHRBKDM4EALDH1A1MEN1

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