SCHEMBL15030596

SCHEMBL15030596

CN(C)C(=O)n1nnnc1CCCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 7/20 1.00
MGLL Q99685 4/20 0.63
FAAH O00519 1/20 0.63
ALDH1A1 P00352 1/20 0.63
TRPV1 Q8NER1 4/20 0.58

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
SCHEMBL2183633 0.85 MGLL (0.85) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL2184828 0.77 MGLL (1.00) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL2182851 0.77 DAGLA (0.65) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL2184337 0.74 MGLL (0.64) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL2181312 0.73 MGLL (0.70) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL12414610 0.72 TRPV1 (0.92) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL12414589 0.71 TRPV1 (0.72) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL12414577 0.71 TRPV1 (0.72) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL12414572 0.71 TRPV1 (0.72) DAGLAMGLLFAAHALDH1A1TRPV1
SCHEMBL2181664 0.71 TRPV1 (0.72) DAGLAMGLLFAAHALDH1A1TRPV1

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-20130224151-A1 Use of FAAH Inhibitors for Treating Abdominal, Visceral and Pelvic Pain UNITED STATES OF AMERICA (US) 2013-08-29 US disclosed
US-20130150346-A1 Use of FAAH Inhibitors for Treating Parkinson's Disease and Restless Legs Syndrome QUEST VENTURES LTD. (GB) 2013-06-13 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-20130224151-A1 Use of FAAH Inhibitors for Treating Abdominal, Visceral and Pelvic Pain FAAH, FAAH2, PNLIP DAGLA 40/4885MGLL 5/4885FAAH 1/4885
US-20130150346-A1 Use of FAAH Inhibitors for Treating Parkinson's Disease and Restless Legs Syndrome FAAH, FAAH2, MGLL DAGLA 31/4885MGLL 3/4885FAAH 1/4885

“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.