SCHEMBL685237

SCHEMBL685237

O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 2/20 0.67
PTPN5 P54829 2/20 0.67
PTPN11 Q06124 2/20 0.67
MAPT P10636 6/20 0.62
ALDH1A1 P00352 4/20 0.62
MEN1 O00255 7/20 0.60
KMT2A Q03164 7/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
TDP1 Q9NUW8 3/20 0.60
NPC1 O15118 2/20 0.60
KDM4E B2RXH2 2/20 0.60
USP2 O75604 1/20 0.60
MCOLN3 Q8TDD5 1/20 0.60
GFER P55789 1/20 0.59
LMNA P02545 6/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
HTT P42858 5/20 0.57
OPRK1 P41145 2/20 0.56
POLB P06746 2/20 0.56
AGTR1 P30556 1/20 0.56

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
SCHEMBL683992 0.89 DUSP3 (0.65) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL684938 0.89 DUSP3 (0.65) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL684798 0.89 DUSP3 (0.73) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL683745 0.88 MEN1 (0.67) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL685289 0.87 DUSP3 (0.61) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL686334 0.87 DUSP3 (0.61) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL683720 0.86 DUSP3 (0.76) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL685159 0.85 NPC1 (0.70) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL684747 0.85 DUSP3 (0.67) DUSP3PTPN5PTPN11MAPTALDH1A1
SCHEMBL683973 0.83 DUSP3 (0.76) DUSP3PTPN5PTPN11MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 DUSP3 858/4885PTPN5 1027/4885PTPN11 1940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.