SCHEMBL5131900

SCHEMBL5131900

CCCCC(CC)C(=O)Nc1ccc(N2CC[N]CC2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 18/20 0.56
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.52

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
SCHEMBL4009548 0.80 NPY2R (0.61) NPY2RKDM4E
SCHEMBL5077990 0.80 NPY2R (0.69) NPY2R
Hydrochloric Acid SCHEMBL4003406 0.79 NPY2R (0.60) NPY2RKDM4E
Hydrochloric Acid SCHEMBL5077975 0.79 NPY2R (0.60) NPY2RKDM4E
SCHEMBL5078009 0.79 NPY2R (0.87) NPY2R
SCHEMBL7600615 0.79 NPY2R (0.87) NPY2R
SCHEMBL5128217 0.77 SHMT2 (0.53) NPY2RLMNA
SCHEMBL4004710 0.77 NPY2R (0.60) NPY2RKDM4E
SCHEMBL21670263 0.76 LMNA (0.62) LMNA
SCHEMBL5133152 0.76 KDM4E (0.52) NPY2RKDM4ELMNA

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-8183239-B2 Substituted piperazines and piperidines as modulators of the neuropeptide Y2 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-05-22 US disclosed
US-20070100141-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 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-20070100141-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY5R, NPY4R NPY2R 1/4885KDM4E 1365/4885LMNA 3057/4885

“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.