SCHEMBL5778811

SCHEMBL5778811

C(=NNc1ccc(-c2cnco2)cc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.54
RAB9A P51151 7/20 0.51
NPC1 O15118 6/20 0.51
KMT2A Q03164 6/20 0.51
LMNA P02545 5/20 0.51
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 3/20 0.51
PKM P14618 2/20 0.51
POLB P06746 2/20 0.51
MAPT P10636 8/20 0.46
MEN1 O00255 5/20 0.46
GAA P10253 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPK1 P28482 1/20 0.46
GFER P55789 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HPGD P15428 1/20 0.44
NOTUM Q6P988 1/20 0.44
PORCN Q9H237 1/20 0.44
CYP11B1 P15538 1/20 0.43

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
SCHEMBL5778806 1.00 NOX1 (0.54) NOX1RAB9ANPC1KMT2ALMNA
SCHEMBL5776228 0.89 RAB9A (0.55) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL14742652 0.89 RAB9A (0.55) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL5776531 0.88 MAPT (0.61) RAB9ANPC1KMT2ALMNAALDH1A1
Hydrochloric Acid SCHEMBL5778200 0.88 RAB9A (0.57) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL5777785 0.86 MPO (0.50) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL5779274 0.86 NPC1 (0.47) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL5779700 0.86 GAA (0.42) NOX1RAB9ANPC1KMT2ALMNA
SCHEMBL5779271 0.86 NPC1 (0.47) RAB9ANPC1KMT2ALMNAALDH1A1
SCHEMBL5777782 0.86 MPO (0.50) RAB9ANPC1KMT2ALMNAALDH1A1

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 NOX1 1745/4885RAB9A 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.