SCHEMBL5454430

SCHEMBL5454430

CC(C)Oc1cccc2c(C(=O)NCc3ccc(Cl)c(Cl)c3)cn(CCCN3CCN(CCOc4ccc(Cl)c5ccccc45)CC3)c12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.41
CNR1 P21554 3/20 0.41
FSCN1 Q16658 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
MAPK14 Q16539 1/20 0.39
WDR5 P61964 1/20 0.38
HTR1A P08908 2/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
APEX1 P27695 1/20 0.37
PDE10A Q9Y233 1/20 0.36
KMT2A Q03164 1/20 0.36
DRD3 P35462 1/20 0.35
HTR7 P34969 1/20 0.35

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
SCHEMBL14463755 0.93 CNR2 (0.38) CNR2CNR1FSCN1MAPK14HTR1A
SCHEMBL14411428 0.93 CNR2 (0.40) CNR2HTR1ADRD2HTR2APDE10A
SCHEMBL5446369 0.92 PTPN7 (0.44) CNR2CNR1FSCN1HTR1DHTR1B
SCHEMBL5452419 0.92 CNR2 (0.46) CNR2CNR1HTR1DHTR1BAPEX1
SCHEMBL14411415 0.90 PTPN7 (0.42) CNR2CNR1FSCN1HTR1DHTR1B
SCHEMBL5440849 0.90 CNR2 (0.40) CNR2CNR1FSCN1HTR1ADRD2
SCHEMBL5462928 0.90 CNR2 (0.44) CNR2CNR1FSCN1HTR1ADRD2
SCHEMBL5453673 0.89 CNR1 (0.44) CNR2CNR1FSCN1HTR1DHTR1B
SCHEMBL5459780 0.88 CNR2 (0.46) CNR2CNR1FSCN1APEX1PDE10A
SCHEMBL5451293 0.88 CNR2 (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 106/4885CNR1 65/4885FSCN1 4090/4885

“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.