SCHEMBL8737473

SCHEMBL8737473

N#Cc1cc(NC(=O)C2CCC2)ccc1N1CCN(C(c2ccccc2)c2ncco2)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 15/20 0.61
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MALT1 Q9UDY8 1/20 0.42
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8737449 0.98 NPY2R (0.60) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8737596 0.97 NPY2R (0.63) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8737591 0.92 NPY2R (0.59) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8736203 0.91 NPY2R (0.58) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8737451 0.89 NPY2R (0.49) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8735916 0.89 NPY2R (0.57) NPY2RMEN1MAPTKMT2A
SCHEMBL6115368 0.88 NPY2R (0.68) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8735996 0.87 NPY2R (0.59) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL8737971 0.86 NPY2R (0.59) NPY2RMEN1ALDH1A1MAPTHPGD
SCHEMBL6116011 0.86 NPY2R (0.70) NPY2RMEN1KMT2AKDM4E

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-20120129870-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-05-24 US disclosed
WO-2009079597-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-25 WO 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-20120129870-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY1R, NPY5R NPY2R 1/4885MEN1 2747/4885ALDH1A1 4338/4885

“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.