SCHEMBL5452419

SCHEMBL5452419

COc1cccc2c(C(=O)NCc3ccc(Cl)c(Cl)c3)cn(CCCN3CCN(CCOc4ccc(Cl)c5ccccc45)CC3)c12

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.46
APEX1 P27695 1/20 0.42
CNR1 P21554 4/20 0.42
LMNA P02545 2/20 0.42
CCR3 P51677 1/20 0.41
PDE10A Q9Y233 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HPGD P15428 1/20 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
SCHEMBL5441597 0.93 PDE10A (0.49) CNR2APEX1PDE10A
SCHEMBL14463927 0.93 CNR2 (0.42) CNR2LMNAPDE10AHPGD
SCHEMBL5448781 0.93 PDE10A (0.49) CNR2PDE10A
SCHEMBL5444287 0.93 CNR2 (0.45) CNR2LMNAPDE10A
SCHEMBL5454430 0.92 CNR2 (0.41) CNR2APEX1CNR1PDE10AHTR1D
SCHEMBL5448813 0.92 CNR2 (0.48) CNR2APEX1CNR1LMNAPDE10A
SCHEMBL5453673 0.91 CNR1 (0.44) CNR2APEX1CNR1PDE10AHTR1D
SCHEMBL14412051 0.90 CNR2 (0.47) CNR2APEX1CNR1CCR3PDE10A
SCHEMBL5455426 0.90 CNR2 (0.44) CNR2APEX1CNR1LMNAPDE10A
SCHEMBL5448912 0.89 CNR2 (0.49) CNR2APEX1CNR1LMNACCR3

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 106/4885APEX1 3945/4885CNR1 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.