SCHEMBL6716650

SCHEMBL6716650

[CH2]CCCCCCCCCCCCCN1CCCC1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.70
MAPT P10636 2/20 0.48
SIGMAR1 Q99720 2/20 0.45
CXCR4 P61073 1/20 0.45
CYP1A2 P05177 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
ALOX15 P16050 1/20 0.40
HRH1 P35367 1/20 0.39
HRH4 Q9H3N8 1/20 0.39

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
SCHEMBL5388937 1.00 HRH3 (0.70) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL9216464 1.00 HRH3 (0.70) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL5397114 1.00 HRH3 (0.70) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL3389073 1.00 HRH3 (0.70) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL5397440 1.00 HRH3 (0.70) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL6715590 0.97 HRH3 (0.75) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL5395587 0.97 HRH3 (0.75) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL10709367 0.97 HRH3 (0.75) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL11460076 0.97 HRH3 (0.75) HRH3MAPTSIGMAR1CXCR4CYP1A2
SCHEMBL5385522 0.97 HRH3 (0.75) HRH3MAPTSIGMAR1CXCR4CYP1A2

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-20040127433-A1 excellent antibacterial activity especially against a typical acid-fast mycobacteria including multiple drug-resistant bacteria HOKURIKU SEIYAKU CO., LTD. (JP) 2004-07-01 US disclosed
EP-1323726-A1 ERYTHROMYCIN DERIVATIVES AND MEDICINES CONTAINING THE SAME HOKURIKU SEIYAKU CO., LTD. (JP) 2003-07-02 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-20040127433-A1 excellent antibacterial activity especially against a typical acid-fast mycobacteria including multiple drug-resistant bacteria MAPRE1, MAPRE2, MRPS27 HRH3 1919/4885MAPT 4237/4885SIGMAR1 149/4885

“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.