SCHEMBL12563340

SCHEMBL12563340

CCC1CCc2c(Oc3nc(C(=O)N[C@H](C)c4cc(F)c(C)c(F)c4)co3)cccc21

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 15/20 0.40
MME P08473 2/20 0.33
ACACB O00763 2/20 0.32

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
SCHEMBL12604073 0.90 PDE2A (0.35) PDE2AMMEACACB
SCHEMBL1987794 0.90 PDE2A (0.35) PDE2AMMEACACB
SCHEMBL12563329 0.90 PDE2A (0.41) PDE2AACACB
SCHEMBL12563400 0.88 PDE2A (0.40) PDE2AACACB
SCHEMBL12563342 0.87 PDE2A (0.40) PDE2AACACB
SCHEMBL12563392 0.82 SCN9A (0.38) PDE2AACACB
SCHEMBL12563325 0.81 PDE2A (0.37) PDE2A
SCHEMBL12605015 0.79 PDE2A (0.36) PDE2A
SCHEMBL1986580 0.79 PDE2A (0.36) PDE2A
SCHEMBL12563339 0.79 PDE2A (0.36) PDE2A

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-20110152318-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2011-06-23 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-20110152318-A1 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME TRPV1, TRPA1, TRPV2 PDE2A 1939/4885MME 813/4885ACACB 4713/4885

“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.