SCHEMBL683783

SCHEMBL683783

C/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
RECQL P46063 2/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
GAA P10253 3/20 0.54
MAPK1 P28482 1/20 0.54
LMNA P02545 2/20 0.51
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.48
HTT P42858 1/20 0.48
KDM1A O60341 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL684560 0.85 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AGAALMNA
SCHEMBL685082 0.83 KDM1A (0.58) ALDH1A1MEN1KMT2AGAALMNA
SCHEMBL684513 0.82 KMT2A (0.55) ALDH1A1RECQLMEN1KMT2AGAA
SCHEMBL684689 0.82 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AGAAMAPK1
SCHEMBL684768 0.81 SMN1; SMN2 (0.55) ALDH1A1MEN1KMT2AGAALMNA
SCHEMBL684810 0.81 MEN1 (0.66) ALDH1A1RECQLMEN1KMT2AGAA
SCHEMBL684674 0.81 ALDH1A1 (0.53) ALDH1A1RECQLMEN1KMT2AGAA
SCHEMBL684551 0.80 KDM1A (0.70) ALDH1A1MEN1KMT2AGAALMNA
SCHEMBL684920 0.80 SMN1; SMN2 (0.52) ALDH1A1MEN1KMT2AGAALMNA
SCHEMBL684079 0.79 ALDH1A1 (0.51) ALDH1A1RECQLMEN1KMT2AGAA

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-20120141597-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-07 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 (2 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 ALDH1A1 127/4885RECQL 4232/4885MEN1 536/4885
US-20120141597-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 ALDH1A1 115/4885RECQL 3762/4885MEN1 508/4885

“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.