SCHEMBL685193

SCHEMBL685193

O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.67
MEN1 O00255 9/20 0.67
KMT2A Q03164 9/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
KDM4E B2RXH2 5/20 0.67
HTT P42858 5/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
LMNA P02545 3/20 0.67
HPGD P15428 2/20 0.67
TP53 P04637 2/20 0.67
DUSP3 P51452 1/20 0.60
PTPN5 P54829 1/20 0.60
PTPN11 Q06124 1/20 0.60
NPC1 O15118 6/20 0.58
RAB9A P51151 4/20 0.58
ALDH1A1 P00352 2/20 0.57
MITF O75030 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
THRB P10828 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL15917584 0.89 NPC1 (0.70) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL15917585 0.89 NPC1 (0.70) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL12387893 0.88 MAPT (0.65) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16077670 0.83 NPC1 (0.69) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16034594 0.83 NPC1 (0.69) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL684619 0.83 MEN1 (0.70) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL684612 0.83 MEN1 (0.72) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1520094 0.83 MAPT (0.65) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1520095 0.83 MAPT (0.65) MAPTMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL29741767 0.81 MAPT (0.77) MAPTMEN1KMT2ASMN1; SMN2KDM4E

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 1491/4885MEN1 536/4885KMT2A 1362/4885

“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.