SCHEMBL101661

SCHEMBL101661

CCOC(=O)CNC(=O)OCc1ccc(OC(C)=O)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.49
LTA4H P09960 2/20 0.44
ALDH1A1 P00352 4/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
JUN P05412 1/20 0.41
NFKB1 P19838 1/20 0.41
DRD2 P14416 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GLA P06280 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
PPID Q08752 1/20 0.40
THRB P10828 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL102366 0.87 PTGS1 (0.54) PTGS1LTA4HALDH1A1TSHRSMN1; SMN2
SCHEMBL102371 0.82 MGLL (0.52) PTGS1LTA4HTRPV1
SCHEMBL102688 0.81 PTGS1 (0.49) PTGS1LTA4HALDH1A1TSHRJUN
SCHEMBL102357 0.81 PTGS1 (0.51) PTGS1ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL101952 0.81 MGLL (0.58) PTGS1LTA4HTRPV1
SCHEMBL102358 0.81 MGLL (0.58) PTGS1LTA4HTRPV1
SCHEMBL101957 0.81 MGLL (0.58) PTGS1LTA4HTRPV1
SCHEMBL102356 0.81 MGLL (0.58) PTGS1LTA4HTRPV1
SCHEMBL102685 0.81 MGLL (0.58) PTGS1LTA4HTRPV1
SCHEMBL102375 0.80 ALDH1A1 (0.54) PTGS1ALDH1A1SMN1; SMN2GLAPKM

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 5 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-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

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 PTGS1 74/4885LTA4H 16/4885ALDH1A1 2053/4885

“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.