SCHEMBL5779571

SCHEMBL5779571

CN(C)Cc1ccc(/C=N/Nc2ccc(I)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.48
NOX1 Q9Y5S8 2/20 0.41
GAA P10253 9/20 0.40
RAB9A P51151 5/20 0.40
NPC1 O15118 4/20 0.40
MAPT P10636 8/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
HPGD P15428 4/20 0.40
LMNA P02545 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 4/20 0.38
MITF O75030 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
GSK3B P49841 1/20 0.37
PYCR1 P32322 1/20 0.36
KDM4E B2RXH2 3/20 0.35
MAPK1 P28482 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
SCHEMBL5779576 1.00 MPO (0.48) MPONOX1GAARAB9ANPC1
SCHEMBL5776306 0.81 MPO (0.42) MPONOX1GAARAB9ANPC1
SCHEMBL5776311 0.81 MPO (0.42) MPONOX1GAARAB9ANPC1
SCHEMBL5779169 0.80 MPO (0.72) MPONOX1GAARAB9ANPC1
SCHEMBL5779166 0.80 MPO (0.72) MPONOX1GAARAB9ANPC1
SCHEMBL5777001 0.78 MPO (0.38) MPONOX1GAARAB9ANPC1
SCHEMBL5777002 0.78 MPO (0.38) MPONOX1GAARAB9ANPC1
Dimethylamine SCHEMBL5779577 0.75 GAA (0.59) MPONOX1GAARAB9ANPC1
SCHEMBL5779782 0.75 LMNA (0.40) MPOGAARAB9ANPC1MAPT
SCHEMBL5779785 0.75 LMNA (0.40) MPOGAARAB9ANPC1MAPT

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.