SCHEMBL683724

SCHEMBL683724

C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.67
GAA P10253 5/20 0.67
ALDH1A1 P00352 4/20 0.67
RAB9A P51151 5/20 0.65
KMT2A Q03164 5/20 0.65
MEN1 O00255 4/20 0.65
MAPK1 P28482 1/20 0.65
POLB P06746 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
KDM4E B2RXH2 2/20 0.65
LMNA P02545 2/20 0.65
HTT P42858 2/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
BLM P54132 1/20 0.65
CTDSP1 Q9GZU7 1/20 0.65
NPC1 O15118 3/20 0.64
DUSP3 P51452 1/20 0.60
PTPN5 P54829 1/20 0.60
PTPN11 Q06124 1/20 0.60
KDM1A O60341 1/20 0.60

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
SCHEMBL684654 0.86 KDM1A (0.71) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL683725 0.81 KDM1A (0.67) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL684658 0.80 KDM1A (0.83) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL12316802 0.80 KDM1A (0.65) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL684770 0.80 NPC1 (0.69) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL684535 0.80 KDM1A (0.65) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL684473 0.80 MTOR (0.77) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL684771 0.80 KDM1A (0.70) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL27178072 0.80 MAPT (0.73) MAPTGAAALDH1A1RAB9AKMT2A
SCHEMBL27178075 0.80 MAPT (0.73) MAPTGAAALDH1A1RAB9AKMT2A

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 MAPT 1491/4885GAA 670/4885ALDH1A1 127/4885

“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.