SCHEMBL7981970

SCHEMBL7981970

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 2/20 0.34
PLAU P00749 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 2/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2D6 P10635 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GAA P10253 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
MCL1 Q07820 1/20 0.31
THRB P10828 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
SCHEMBL7979199 0.99 KDM4E (0.39) KDM4EALDH1A1TDP1PLAUPOLB
SCHEMBL7982351 0.96 KDM4E (0.38) KDM4EALDH1A1TDP1PLAUPOLB
SCHEMBL7981941 0.92 PLAU (0.40) KDM4EALDH1A1TDP1PLAUPOLB
SCHEMBL7979192 0.91 KDM4E (0.38) KDM4EALDH1A1TDP1PLAUTP53
SCHEMBL7981958 0.91 PLAU (0.40) KDM4EPLAUTHRB
SCHEMBL8409215 0.90 KDM4E (0.41) KDM4EALDH1A1TDP1POLBTP53
SCHEMBL7982158 0.90 KDM4E (0.37) KDM4EALDH1A1TDP1PLAUTP53
SCHEMBL7975926 0.90 PLAU (0.39) KDM4EPLAUTHRB
SCHEMBL8409895 0.89 KDM4E (0.41) KDM4EALDH1A1TDP1POLBTP53
SCHEMBL8408834 0.89 KDM4E (0.41) KDM4EALDH1A1TDP1POLBTP53

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