SCHEMBL5451298

SCHEMBL5451298

COc1cccc2c(C(=O)NCc3cccc(Cl)c3)cn(CCCN3CCC(C(=O)c4ccccc4)CC3)c12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.51
CNR2 P34972 5/20 0.48
WNT3A P56704 1/20 0.45
TNKS2 Q9H2K2 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CCR3 P51677 1/20 0.44
APEX1 P27695 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
HTR2A P28223 1/20 0.43
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 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
SCHEMBL5453968 0.92 CNR2 (0.49) PDE10ACNR2WNT3ATNKS2CCR3
SCHEMBL14464432 0.89 HTR2A (0.44) PDE10AMEN1KMT2AKDM4ECYP1A2
SCHEMBL5448407 0.89 PDE10A (0.50) PDE10ACNR2MEN1KMT2AUSP2
SCHEMBL5454644 0.89 PDE10A (0.51) PDE10ACNR2MEN1KMT2AUSP2
SCHEMBL5440891 0.87 PDE10A (0.51) PDE10ACNR2MEN1KMT2ACCR3
SCHEMBL5445470 0.86 CNR2 (0.53) PDE10ACNR2MEN1KMT2AUSP2
SCHEMBL5449136 0.86 PDE10A (0.52) PDE10ACNR2MEN1KMT2AAPEX1
SCHEMBL5396542 0.86 CNR2 (0.51) CNR2WNT3ATNKS2CYP2D6ALDH1A1
SCHEMBL5460619 0.86 PDE10A (0.50) PDE10ACNR2MEN1KMT2ACCR3
SCHEMBL5463330 0.85 PDE10A (0.51) PDE10ACNR2MEN1KMT2AAPEX1

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 PDE10A 514/4885CNR2 106/4885WNT3A 3051/4885

“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.