SCHEMBL101957

SCHEMBL101957

CCCCCCCNC(=O)OCc1ccc(OC(C)=O)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.58
TRPV1 Q8NER1 1/20 0.55
LTA4H P09960 2/20 0.51
EPHX2 P34913 1/20 0.50
PTGS1 P23219 1/20 0.48

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
SCHEMBL102358 1.00 MGLL (0.58) MGLLTRPV1LTA4HEPHX2PTGS1
SCHEMBL101952 1.00 MGLL (0.58) MGLLTRPV1LTA4HEPHX2PTGS1
SCHEMBL102356 1.00 MGLL (0.58) MGLLTRPV1LTA4HEPHX2PTGS1
SCHEMBL102685 1.00 MGLL (0.58) MGLLTRPV1LTA4HEPHX2PTGS1
SCHEMBL102371 0.95 MGLL (0.52) MGLLTRPV1LTA4HEPHX2PTGS1
SCHEMBL102366 0.86 PTGS1 (0.54) TRPV1LTA4HEPHX2PTGS1
SCHEMBL102357 0.85 PTGS1 (0.51) TRPV1PTGS1
SCHEMBL102688 0.83 PTGS1 (0.49) TRPV1LTA4HPTGS1
SCHEMBL2208675 0.82 LTA4H (0.56) TRPV1LTA4HEPHX2PTGS1
SCHEMBL101827 0.82 LTA4H (0.47) MGLLTRPV1LTA4HEPHX2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8343971-B2 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-01-01 US claimed
US-20120059007-A1 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-03-08 US claimed
US-8343971-B2 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-01-01 US disclosed
US-8343971-B2 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-01-01 US disclosed
US-8343971-B2 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-01-01 US disclosed
US-20120059007-A1 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-03-08 US disclosed
US-20120059007-A1 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-03-08 US disclosed
US-20120059007-A1 Pharmacologically-active vanilloid carbamates RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2012-03-08 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 (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-20120059007-A1 Pharmacologically-active vanilloid carbamates FAAH, FAAH2, TRPV1 MGLL 915/4885TRPV1 3/4885LTA4H 16/4885

“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.