SCHEMBL4734665

SCHEMBL4734665

COc1cccc(OC(CCN(C)C)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.60
HRH3 Q9Y5N1 4/20 0.60
SLC6A9 P48067 1/20 0.54
UTS2R Q9UKP6 1/20 0.51

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
Oxalic Acid SCHEMBL7309554 0.95 SLC6A9 (0.56) SLC6A4HRH3SLC6A9UTS2R
SCHEMBL5270870 0.87 SLC6A4 (0.70) SLC6A4HRH3SLC6A9
SCHEMBL7158810 0.86 SLC6A4 (0.73) SLC6A4HRH3SLC6A9
SCHEMBL4735200 0.84 SLC6A4 (0.56) SLC6A4HRH3SLC6A9
SCHEMBL5078074 0.83 SLC6A4 (0.59) SLC6A4HRH3SLC6A9
SCHEMBL7051306 0.82 SLC6A4 (0.54) SLC6A4
SCHEMBL9398411 0.81 SLC6A4 (0.74) SLC6A4HRH3SLC6A9
Oxalic Acid SCHEMBL7309230 0.81 SLC6A4 (0.53) SLC6A4HRH3SLC6A9
Oxalic Acid SCHEMBL7302789 0.80 SLC6A4 (0.62) SLC6A4HRH3SLC6A9UTS2R
Maleic Acid SCHEMBL7319208 0.80 SLC6A9 (0.64) SLC6A4HRH3SLC6A9

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-20080139564-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-12 US disclosed
WO-2008064036-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-29 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-20080139564-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS HRH3, SLC6A4, HNMT SLC6A4 2/4885HRH3 1/4885SLC6A9 97/4885

“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.