SCHEMBL7600623

SCHEMBL7600623

Cc1c(CCN2CCCCC2C)c(=O)oc2ccc(-c3ccc(C(=O)N4CCOCC4)cc3)cc12

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.67
SLC6A4 P31645 2/20 0.46
HRH1 P35367 2/20 0.46
HTR1A P08908 1/20 0.46
KCNH2 Q12809 1/20 0.46
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
ADRA2C P18825 1/20 0.43
CHRM3 P20309 1/20 0.43
DRD4 P21917 1/20 0.43
SLC6A2 P23975 1/20 0.43
HRH2 P25021 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HRH4 Q9H3N8 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
SCHEMBL7597889 0.97 HRH3 (0.67) HRH3SLC6A4HRH1HTR1AKCNH2
SCHEMBL7602672 0.93 HRH3 (0.65) HRH3SLC6A4HRH1HTR1AKCNH2
SCHEMBL7601498 0.91 HRH3 (0.64) HRH3SLC6A4HRH1HTR1AKCNH2
SCHEMBL7598173 0.87 HRH3 (0.61) HRH3KCNH2
SCHEMBL7602733 0.82 HRH3 (0.64) HRH3HRH1KCNH2HRH2
SCHEMBL2785692 0.80 HRH3 (1.00) HRH3
SCHEMBL7602694 0.80 HRH3 (0.58) HRH3
SCHEMBL2784525 0.79 HRH3 (0.63) HRH3HRH1KCNH2HRH2
SCHEMBL7599795 0.79 HRH3 (0.63) HRH3HRH1KCNH2HRH2
SCHEMBL2785967 0.79 HRH3 (0.63) HRH3HRH1KCNH2HRH2

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-20020183309-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications ABBOTT LABORATORIES 2002-12-05 US disclosed
US-20020177589-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications ABBOTT LABORATORIES 2002-11-28 US 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 (2 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-20020177589-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 HRH3 1/4885SLC6A4 570/4885HRH1 3/4885
US-20020183309-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 HRH3 1/4885SLC6A4 570/4885HRH1 3/4885

“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.