SCHEMBL1367550

SCHEMBL1367550

CC1CN(c2ncccc2C(F)(F)F)CCC1=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.52
HSD11B1 P28845 13/20 0.51
TRPV1 Q8NER1 3/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL1368883 0.81 LMNA (0.47) HSD11B1TRPV1
SCHEMBL1367888 0.80 HSD11B1 (0.46) HSD11B1TRPV1
SCHEMBL2031083 0.80 HSD11B1 (0.46) HSD11B1TRPV1
SCHEMBL1369593 0.79 EPHX2 (0.66) EPHX2HSD11B1GAA
SCHEMBL3630668 0.76 EPHX2 (0.66) EPHX2HSD11B1TRPV1GAA
SCHEMBL1457210 0.76 EPHX2 (0.66) EPHX2HSD11B1TRPV1GAA
SCHEMBL1734757 0.76 EPHX2 (0.66) EPHX2HSD11B1TRPV1GAA
SCHEMBL27761289 0.76 HSD11B1 (0.55) EPHX2HSD11B1TRPV1GAA
SCHEMBL4266990 0.74 TRPV1 (0.69) EPHX2HSD11B1TRPV1GAA
Trifluoroacetic Acid SCHEMBL15655268 0.73 DPP4 (0.48) HSD11B1TRPV1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110288129-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2011-11-24 US disclosed
US-7998982-B2 Amide derivatives as TRPV1 antagonists ABBOTT LABORATORIES (US) 2011-08-16 US disclosed
US-20090062345-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2009-03-05 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-20090062345-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPA1 EPHX2 912/4885HSD11B1 3218/4885TRPV1 1/4885
US-20110288129-A1 AMIDE DERIVATIVES AS TRPV1 ANTAGONISTS TRPV1, TRPV3, TRPA1 EPHX2 912/4885HSD11B1 3218/4885TRPV1 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.