SCHEMBL5776306

SCHEMBL5776306

CNCc1ccc(/C=N/Nc2ccc(I)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.42
NOX1 Q9Y5S8 2/20 0.42
GAA P10253 8/20 0.41
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
MAPT P10636 7/20 0.41
HPGD P15428 4/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MITF O75030 2/20 0.39
KDM4E B2RXH2 2/20 0.36
MAPK1 P28482 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
APP P05067 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
DDX3X O00571 1/20 0.35

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
SCHEMBL5776311 1.00 MPO (0.42) MPONOX1GAARAB9ANPC1
SCHEMBL5779571 0.81 MPO (0.48) MPONOX1GAARAB9ANPC1
SCHEMBL5779576 0.81 MPO (0.48) MPONOX1GAARAB9ANPC1
Dimethylamine SCHEMBL5779577 0.80 GAA (0.59) MPONOX1GAARAB9ANPC1
SCHEMBL5778184 0.79 APP (0.46) GAARAB9ANPC1MAPTHPGD
SCHEMBL5778186 0.79 APP (0.46) GAARAB9ANPC1MAPTHPGD
SCHEMBL8339267 0.76 CYP3A4 (0.54) MAPTKDM4EAPPLOXL2
SCHEMBL5779169 0.75 MPO (0.72) MPONOX1GAARAB9ANPC1
SCHEMBL5779166 0.75 MPO (0.72) MPONOX1GAARAB9ANPC1
SCHEMBL5779773 0.74 LMNA (0.40) GAARAB9ANPC1MAPTMEN1

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 MPO 2642/4885NOX1 1745/4885GAA 3175/4885

“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.