SCHEMBL8736203

SCHEMBL8736203

N#Cc1cc(NC(=O)[C@@H]2CCOC2)ccc1N1CCN(C(c2ccccc2)c2ncco2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 16/20 0.58
PIP5K1C O60331 3/20 0.43
PIK3CA P42336 3/20 0.43
PIP5K1B O14986 1/20 0.43
MAPK8 P45983 1/20 0.43
MAPK10 P53779 1/20 0.43
MAPK14 Q16539 1/20 0.43
PIP5K1A Q99755 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL8737596 0.92 NPY2R (0.63) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL8737473 0.91 NPY2R (0.61) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL8737449 0.90 NPY2R (0.60) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL13873603 0.90 NPY2R (0.57) NPY2RPIP5K1CPIK3CAPIP5K1BMAPK8
SCHEMBL8737930 0.89 NPY2R (0.63) NPY2RPIP5K1CPIK3CAPIP5K1BMAPK8
SCHEMBL8737591 0.87 NPY2R (0.59) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL6115368 0.85 NPY2R (0.68) NPY2RKDM4EMEN1ALDH1A1MAPT
SCHEMBL6116011 0.83 NPY2R (0.70) NPY2RKDM4EMEN1KMT2A
SCHEMBL8737923 0.83 NPY2R (0.55) NPY2RMAPK8MAPK10MAPK14MEN1
SCHEMBL4128647 0.81 NPY2R (0.84) NPY2R

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 1/4885PIP5K1C 1245/4885PIK3CA 2500/4885

“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.