SCHEMBL683745

SCHEMBL683745

O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.67
KMT2A Q03164 6/20 0.67
KDM4E B2RXH2 5/20 0.67
TDP1 Q9NUW8 3/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
NPC1 O15118 2/20 0.67
USP2 O75604 1/20 0.67
MCOLN3 Q8TDD5 1/20 0.67
MAPT P10636 9/20 0.57
ALDH1A1 P00352 3/20 0.57
LMNA P02545 2/20 0.57
POLB P06746 2/20 0.57
BLM P54132 1/20 0.57
PHGDH O43175 1/20 0.55
PIK3CG P48736 1/20 0.55
GAA P10253 1/20 0.53
SIRT1 Q96EB6 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KDM1A O60341 1/20 0.52
HTT P42858 1/20 0.52

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
SCHEMBL684609 0.89 MAPT (0.58) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684777 0.89 SIRT1 (0.63) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL685237 0.88 DUSP3 (0.67) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684862 0.86 KDM4E (0.79) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL685678 0.86 PHGDH (0.67) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684647 0.86 PHGDH (0.61) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684234 0.85 MAPT (0.60) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684833 0.85 KDM1A (0.73) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL13549813 0.84 LMNA (0.59) MEN1KMT2AKDM4ETDP1L3MBTL1
SCHEMBL684848 0.84 NPC1 (0.75) MEN1KMT2AKDM4ETDP1L3MBTL1

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 MEN1 536/4885KMT2A 1362/4885KDM4E 1473/4885

“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.