SCHEMBL21027660

SCHEMBL21027660

CC(C=O)CC(N)CCCCN

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.36
RNPEP Q9H4A4 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
TRPA1 O75762 1/20 0.31
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 1/20 0.30

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
SCHEMBL16351266 0.81
SCHEMBL17528672 0.81
SCHEMBL18822638 0.76 ANPEP (0.44) GSRTRPV1TRPA1
SCHEMBL15868808 0.76 ANPEP (0.44) GSRTRPV1TRPA1
SCHEMBL24817188 0.76 ANPEP (0.44) GSRTRPV1TRPA1
SCHEMBL16247205 0.74 ANPEP (0.42) GSRTRPV1TRPA1
SCHEMBL8160766 0.73
SCHEMBL9436941 0.73 DNM1 (0.47) GSR
SCHEMBL22126177 0.71 TRPV1 (0.38) GSRTRPV1TRPA1
SCHEMBL23011848 0.71 TRPV1 (0.38) GSRTRPV1TRPA1

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-10669241-B2 PTEN binding compounds, formulations, and uses thereof UNIVERSITY OF SOUTH FLORIDA (US) 2020-06-02 US disclosed
US-20190161450-A1 PTEN BINDING COMPOUNDS, FORMULATIONS, AND USES THEREOF UNIVERSITY OF SOUTH FLORIDA (US) 2019-05-30 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-10669241-B2 PTEN binding compounds, formulations, and uses thereof PTEN, EYA2, PIK3CA GSR 4681/4885RNPEP 4052/4885TRPV1 4265/4885
US-20190161450-A1 PTEN BINDING COMPOUNDS, FORMULATIONS, AND USES THEREOF PTEN, EYA2, PIK3CA GSR 4681/4885RNPEP 4052/4885TRPV1 4265/4885

“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.