SCHEMBL3333852

SCHEMBL3333852

COc1cccc(F)c1OC(c1cccc(F)c1)C1CNCCO1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 19/20 0.69
SLC6A4 P31645 19/20 0.69
SLC6A3 Q01959 13/20 0.69
HRH1 P35367 5/20 0.67
KCNH2 Q12809 1/20 0.53

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
SCHEMBL3328722 1.00 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3HRH1KCNH2
SCHEMBL3328727 1.00 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3HRH1KCNH2
Hydrochloric Acid SCHEMBL3324727 0.99 SLC6A2 (0.68) SLC6A2SLC6A4SLC6A3HRH1KCNH2
Hydrochloric Acid SCHEMBL3324722 0.99 SLC6A2 (0.68) SLC6A2SLC6A4SLC6A3HRH1KCNH2
SCHEMBL3176562 0.91 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3HRH1KCNH2
SCHEMBL3175975 0.91 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3HRH1KCNH2
Hydrochloric Acid SCHEMBL3333504 0.89 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3HRH1
Hydrochloric Acid SCHEMBL3333509 0.89 SLC6A2 (0.62) SLC6A2SLC6A4SLC6A3HRH1
SCHEMBL3333592 0.88 SLC6A2 (0.86) SLC6A2SLC6A4SLC6A3HRH1KCNH2
SCHEMBL3333367 0.88 SLC6A2 (0.86) SLC6A2SLC6A4SLC6A3HRH1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137316-A1 Morpholine Compounds, Pharmaceutically Acceptable Salts Thereof, Pharmaceutical Compositions, and Methods Of Use Thereof FISH PAUL VINCENT 2010-06-03 US claimed

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-20100137316-A1 Morpholine Compounds, Pharmaceutically Acceptable Salts Thereof, Pharmaceutical Compositions, and Methods Of Use Thereof OPRL1, UGT1A1, HTR3B SLC6A2 109/4885SLC6A4 113/4885SLC6A3 98/4885

“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.