SCHEMBL5779824

SCHEMBL5779824

O=[N+]([O-])c1ccc(/C=C/c2cnco2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.58
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
APP P05067 2/20 0.50
FBP1 P09467 1/20 0.49
PTGS2 P35354 6/20 0.47
PTGS1 P23219 2/20 0.47
CYP19A1 P11511 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
HPGD P15428 1/20 0.41

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
SCHEMBL5779831 1.00 MAPT (0.58) MAPTRAB9ANPC1APPFBP1
SCHEMBL9170800 0.77 APP (0.78) MAPTRAB9ANPC1APPFBP1
SCHEMBL9170804 0.77 APP (0.78) MAPTRAB9ANPC1APPFBP1
SCHEMBL14947048 0.77 APP (0.78) MAPTRAB9ANPC1APPFBP1
SCHEMBL458177 0.77 APP (0.78) MAPTRAB9ANPC1APPFBP1
SCHEMBL458178 0.77 APP (0.78) MAPTRAB9ANPC1APPFBP1
SCHEMBL6610065 0.75 GAA (0.47) MAPTRAB9ANPC1APPMEN1
SCHEMBL5779809 0.75 CYP19A1 (0.45) MAPTRAB9ANPC1APPCYP19A1
SCHEMBL6610070 0.75 GAA (0.47) MAPTRAB9ANPC1APPMEN1
SCHEMBL62411 0.74 MAPT (1.00) MAPTRAB9ANPC1APPFBP1

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 EP 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT MAPT 94/4885RAB9A 3127/4885NPC1 952/4885

“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.