SCHEMBL5459780

SCHEMBL5459780

CC(C)Oc1cccc2c(C(=O)NCc3ccc(Cl)c(Cl)c3)cn(CCCN3CCN(CCc4ccccc4)CC3)c12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.46
SIGMAR1 Q99720 2/20 0.45
CNR1 P21554 3/20 0.44
FSCN1 Q16658 1/20 0.42
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
APEX1 P27695 1/20 0.41
PDE10A Q9Y233 2/20 0.40
TRPV1 Q8NER1 1/20 0.40
SMYD2 Q9NRG4 2/20 0.40

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
SCHEMBL5463426 0.98 CNR2 (0.45) CNR2SIGMAR1CNR1FSCN1ADRA1D
SCHEMBL5454163 0.92 CNR2 (0.52) CNR2SIGMAR1CNR1APEX1PDE10A
SCHEMBL5462928 0.91 CNR2 (0.44) CNR2CNR1FSCN1APEX1
SCHEMBL14463739 0.91 CNR2 (0.41) CNR2SIGMAR1CNR1ADRA1DADRA1A
SCHEMBL5446369 0.90 PTPN7 (0.44) CNR2CNR1FSCN1APEX1
SCHEMBL5448680 0.90 CNR2 (0.46) CNR2ADRA1DADRA1AADRA1BPDE10A
SCHEMBL5454762 0.89 CNR2 (0.50) CNR2SIGMAR1CNR1APEX1PDE10A
SCHEMBL5451293 0.89 CNR2 (0.42) CNR2CNR1FSCN1APEX1
SCHEMBL5450158 0.89 CNR2 (0.41) CNR2CNR1FSCN1APEX1PDE10A
SCHEMBL14411415 0.89 PTPN7 (0.42) CNR2CNR1FSCN1APEX1

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 106/4885SIGMAR1 175/4885CNR1 65/4885

“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.