SCHEMBL7250762

SCHEMBL7250762

CC(=O)c1ccc(OCCCN2CCNCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.70
HRH2 P25021 4/20 0.70
HRH1 P35367 4/20 0.70
HRH3 Q9Y5N1 11/20 0.64
ALDH1A1 P00352 2/20 0.61
MEN1 O00255 1/20 0.61
MAPT P10636 1/20 0.61
KMT2A Q03164 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.59
GAA P10253 1/20 0.58
DRD2 P14416 1/20 0.55

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
SCHEMBL6981478 0.87 KDM4E (0.89) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL5213285 0.87 KDM4E (0.89) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL491803 0.86 KDM4E (0.92) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL5855860 0.84 KDM4E (0.90) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL9200735 0.84 HRH3 (0.72) HRH2HRH1HRH3ALDH1A1MEN1
SCHEMBL9530115 0.83 ALDH1A1 (0.81) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL7242885 0.83 HRH3 (0.77) HRH2HRH1HRH3
SCHEMBL7244138 0.82 HRH2 (1.00) HRH2HRH1
SCHEMBL9664644 0.82 KDM4E (0.68) KDM4EHRH2HRH1HRH3ALDH1A1
SCHEMBL491570 0.82 HRH3 (0.72) KDM4EHRH2HRH1HRH3ALDH1A1

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-6559140-B2 Cyclic and bicyclic diamino histamine-3 receptor antagonists ABBOTT LABORATORIES 2003-05-06 US disclosed
US-20010049367-A1 Cyclic and bicyclic diamino histamine-3 receptor antagonists ABBVIE INC. 2001-12-06 US disclosed
WO-2001066534-A2 CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2001-09-13 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-20010049367-A1 Cyclic and bicyclic diamino histamine-3 receptor antagonists HRH4, HRH2, HRH3 KDM4E 2636/4885HRH2 2/4885HRH1 4/4885

“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.