SCHEMBL7977636

SCHEMBL7977636

Cc1cc(OCC=C(Cl)Cl)cc(C)c1OCCCCN

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
PLAU P00749 3/20 0.33
MAPK1 P28482 2/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
SCN4A P35499 2/20 0.31
MCL1 Q07820 1/20 0.31
FFAR4 Q5NUL3 2/20 0.31
F2 P00734 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7982131 0.99 HTT (0.36) HTTPLAUMAPK1TP53KDM4E
SCHEMBL7975798 0.96 HTT (0.38) HTTPLAUMAPK1TP53KDM4E
SCHEMBL7978953 0.92 KDM4E (0.38) HTTPLAUMAPK1TP53KDM4E
SCHEMBL7978918 0.91 PLAU (0.40) HTTPLAUCYP1A2CYP2D6SCN4A
SCHEMBL7982136 0.91 KDM4E (0.38) HTTPLAUMAPK1TP53KDM4E
SCHEMBL7977565 0.90 HTT (0.35) HTTPLAUKDM4EALDH1A1THRA
SCHEMBL7978996 0.89 HTT (0.34) HTTMAPK1TP53THRATHRB
SCHEMBL8405628 0.88 HTT (0.38) HTTMAPK1TP53KDM4EMEN1
SCHEMBL7977888 0.88 KDM4E (0.36) HTTPLAUMAPK1TP53KDM4E
SCHEMBL8407738 0.87 TP53 (0.40) HTTMAPK1TP53KDM4EMEN1

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
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
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