SCHEMBL8634880

SCHEMBL8634880

O=[N+]([O-])c1ccc(Oc2c(Cl)cc(OCC=C(Br)Br)cc2Cl)c([N+](=O)[O-])c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
MAPT P10636 7/20 0.44
ALDH1A1 P00352 4/20 0.44
HSPB1 P04792 3/20 0.44
LMNA P02545 4/20 0.43
TTR P02766 3/20 0.43
KDM4E B2RXH2 2/20 0.42
PKM P14618 2/20 0.42
POLB P06746 2/20 0.41
THRA P10827 1/20 0.40
GAA P10253 3/20 0.39
HTT P42858 3/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
PDE7A Q13946 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL8634064 0.91 PDE7A (0.48) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8636170 0.88 HSPB1 (0.42) MEN1KMT2AMAPTALDH1A1HSPB1
SCHEMBL8633505 0.85 LMNA (0.45) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8632066 0.85 CYP2C9 (0.40) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8632767 0.81 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1HSPB1
SCHEMBL8636378 0.81 PDE7A (0.49) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8637192 0.80 HSPB1 (0.44) MEN1KMT2AMAPTALDH1A1HSPB1
SCHEMBL8631452 0.80 KIF11 (0.41) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL8633785 0.78 HSPB1 (0.43) MEN1KMT2AMAPTALDH1A1HSPB1
SCHEMBL13478283 0.77 MEN1 (0.55) MEN1KMT2AMAPTALDH1A1HSPB1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed