SCHEMBL5448774

SCHEMBL5448774

COc1ccccc1C1CCN(CCCn2cc(C(=O)NCc3cccc(C)c3)c3cccc(OC)c32)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.53
DRD2 P14416 2/20 0.53
CNR2 P34972 11/20 0.48
CNR1 P21554 2/20 0.43
PDE10A Q9Y233 2/20 0.42
CXCR4 P61073 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL5454644 0.92 PDE10A (0.51) DRD4DRD2CNR2CNR1PDE10A
SCHEMBL5453968 0.88 CNR2 (0.49) DRD4DRD2CNR2CNR1PDE10A
SCHEMBL5444434 0.87 CNR2 (0.52) DRD4DRD2CNR2PDE10A
SCHEMBL5448700 0.87 CNR2 (0.54) CNR2CNR1PDE10ACXCR4
SCHEMBL5463014 0.86 SCD (0.47) CNR2CNR1PDE10ACXCR4
SCHEMBL5446468 0.86 LMNA (0.48) CNR2
SCHEMBL5454738 0.85 CNR2 (0.50) DRD4DRD2CNR2CNR1MEN1
SCHEMBL5449903 0.85 CNR2 (0.45) CNR2CNR1PDE10A
SCHEMBL5452292 0.85 CNR2 (0.46) DRD4DRD2CNR2CNR1PDE10A
SCHEMBL5451967 0.85 CNR2 (0.50) DRD4DRD2CNR2PDE10A

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 DRD4 4022/4885DRD2 2688/4885CNR2 106/4885

“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.