SCHEMBL5451967

SCHEMBL5451967

COc1cccc2c(C(=O)NCc3cccc(C)c3)cn(CCCN3CCN(CCCOc4ccccc4)CC3)c12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.50
PTPN7 P35236 1/20 0.48
MET P08581 1/20 0.45
PDE10A Q9Y233 3/20 0.44
DRD2 P14416 3/20 0.42
DRD4 P21917 3/20 0.42
DRD3 P35462 3/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
THRB P10828 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
CHRM3 P20309 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
SCHEMBL5455263 0.98 CNR2 (0.48) CNR2PTPN7METPDE10ADRD2
SCHEMBL5448753 0.98 CNR2 (0.49) CNR2PTPN7METPDE10ADRD2
SCHEMBL5470088 0.95 CNR2 (0.48) CNR2PTPN7METPDE10ADRD2
SCHEMBL14412026 0.92 PDE10A (0.53) CNR2PTPN7METPDE10ADRD2
SCHEMBL5452292 0.92 CNR2 (0.46) CNR2PTPN7PDE10ADRD2DRD4
SCHEMBL5451975 0.92 PTPN7 (0.46) CNR2PTPN7METPDE10ATHRB
SCHEMBL5444434 0.91 CNR2 (0.52) CNR2PDE10ADRD2DRD4DRD3
SCHEMBL5444330 0.91 PDE10A (0.44) CNR2PTPN7PDE10ADRD2DRD3
SCHEMBL14411430 0.90 CNR2 (0.44) CNR2PTPN7METPDE10ADRD2
SCHEMBL5451156 0.90 PDE10A (0.51) CNR2PTPN7METPDE10ADRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF GIPR, GHSR, GHRHR CNR2 106/4885PTPN7 592/4885MET 205/4885

“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.