SCHEMBL4084854

SCHEMBL4084854

O=P(Oc1cc2c(Cl)c(Br)ccc2[nH]1)(Oc1cc2c(Cl)c(Br)ccc2[nH]1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA4 P22748 2/20 0.34
CA5A P35218 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
CA5B Q9Y2D0 2/20 0.34
BRD4 O60885 3/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL4084856 0.87 CA2 (0.36) CYP1A2CYP2C19CA12CA1CA2
SCHEMBL79535 0.83 DAO (0.32)
SCHEMBL7749525 0.81 DAO (0.31)
SCHEMBL29377568 0.81 DAO (0.31)
SCHEMBL79536 0.81 DAO (0.33)
O-Tolylamine SCHEMBL9229915 0.74 MAP2 (0.33) TDP1
SCHEMBL9441965 0.73 RHEB (0.33) CA1CA2BRD4MEN1KMT2A
SCHEMBL4084860 0.72 TDP1 (0.39) TDP1L3MBTL1CYP1A2CYP2C19CA12
SCHEMBL9010844 0.72 DAO (0.32) TDP1CA12CA1CA2CA9
SCHEMBL6140846 0.71 ALDH1A1 (0.33) MEN1KMT2ANPC1MAPTSMN1; SMN2

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
EP-1765057-B1 METHOD FOR AGROBACTERIUM TRANSFORMATION FOR DIHAPLOID CORN PLANTS MONSANTO TECHNOLOGY LLC (US) 2015-10-07 EP disclosed
US-7572635-B2 Method for agrobacterium transformation for dihaploid corn plants MONSANTO TECHNOLOGY LLC (US) 2009-08-11 US disclosed
EP-1765057-A1 METHOD FOR AGROBACTERIUM TRANSFORMATION FOR DIHAPLOID CORN PLANTS Monsanto Technology, LLC (US) 2007-03-28 EP disclosed
WO-2006011959-A1 METHOD FOR AGROBACTERIUM TRANSFORMATION FOR DOHAPLOID CORN PLANTS MONSANTO TECHNOLOGY LLC (US) 2006-02-02 WO disclosed
US-20050289673-A1 A Novel Method for Agrobacterium Transformation for Dihaploid Corn Plants MONSANTO TECHNOLOGY LLC (US) 2005-12-29 US disclosed
US-20040210959-A1 A Novel Method for Production of Transformed Dihaploid Corn Plants MONSANTO TECHNOLOGY LLC (US) 2004-10-21 US disclosed