SCHEMBL4228976

SCHEMBL4228976

O=C(O)c1ccc2c(ccn2CCCN2CCC(O)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
PLG P00747 1/20 0.46
PLAU P00749 1/20 0.46
ESRRG P62508 2/20 0.45
PLA2G4A P47712 2/20 0.41
ACHE P22303 1/20 0.41
P2RX7 Q99572 2/20 0.41
MCL1 Q07820 2/20 0.40
BCL2 P10415 1/20 0.40
ABCB1 P08183 1/20 0.40
MCHR2 Q969V1 1/20 0.39
MCHR1 Q99705 1/20 0.39

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
SCHEMBL4236255 0.86 ESRRG (0.58) DRD4DRD2DRD3PLGPLAU
SCHEMBL6750680 0.84 NOS3 (0.51) DRD4DRD2DRD3PLGPLAU
SCHEMBL4235481 0.84 DRD2 (0.45) DRD4DRD2DRD3ESRRGP2RX7
SCHEMBL4233332 0.79 ESRRG (0.60) PLGPLAUESRRGPLA2G4AACHE
SCHEMBL1663349 0.78 CD274 (0.49) PLGPLAUESRRG
SCHEMBL4813289 0.77 PLG (0.55) PLGPLAUPLA2G4AMCL1BCL2
SCHEMBL1749895 0.77 PLA2G4A (0.59) PLGPLAUPLA2G4AMCL1BCL2
SCHEMBL846081 0.76 PLA2G4A (0.61) PLGPLAUPLA2G4AMCL1BCL2
SCHEMBL12420731 0.75 ACHE (0.53) PLGPLAUPLA2G4AACHE
SCHEMBL1664063 0.75 PLG (0.51) PLGPLAUESRRGPLA2G4AMCL1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US claimed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
US-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R DRD4 423/4885DRD2 337/4885DRD3 384/4885

“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.