SCHEMBL6763359

SCHEMBL6763359

CCN(CC)C(=N)c1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 2/20 0.46
MAPT P10636 1/20 0.46
GFER P55789 1/20 0.46
APP P05067 1/20 0.44
GAA P10253 1/20 0.44
HCAR3 P49019 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
CYP19A1 P11511 1/20 0.44
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
F7 P08709 1/20 0.43
F3 P13726 1/20 0.43
SARM1 Q6SZW1 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT6 Q8N6T7 1/20 0.43
SIRT1 Q96EB6 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
Hydrochloric Acid SCHEMBL6764090 0.98 ALDH1A1 (0.52) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL29552323 0.84 HTT (0.48) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL1460030 0.83 HTT (0.47) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL27320861 0.79 ALDH1A1 (0.54) ALDH1A1KDM4ELMNAHTTNPSR1
Nikethamide SCHEMBL246456 0.79 HTT (0.65) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL11621019 0.79 ALDH1A1 (0.54) ALDH1A1KDM4ELMNAHTTNPSR1
Nikethamide SCHEMBL29754232 0.79 HTT (0.65) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL11068336 0.79 ALDH1A1 (0.61) ALDH1A1KDM4ELMNAHTTNPSR1
SCHEMBL30177678 0.78 L3MBTL1 (0.43) LMNAHTTCHRNA4L3MBTL1
Nikethamide SCHEMBL2477607 0.77 HTT (0.63) ALDH1A1KDM4ELMNAHTTNPSR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067940-A1 Method of enhancing cellular production of molecular chaperon, hydroxylamine derivatives useful for enhancing the chaperon production and the preparation thereof BIOREX RESEARCH & DEVELOPMENT CO. 2004-04-08 US disclosed
EP-0801649-A2 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF BIOREX KUTATO ES FEJLESZTÖ RT. (HU) 1997-10-22 EP disclosed
WO-1997016439-A1 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF Biorex Kutató és Fejlesztó Rt. (HU) 1997-05-09 WO 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-20040067940-A1 Method of enhancing cellular production of molecular chaperon, hydroxylamine derivatives useful for enhancing the chaperon production and the preparation thereof HSPE1, HSF1, HSPA1A ALDH1A1 641/4885KDM4E 3243/4885LMNA 3687/4885

“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.