SCHEMBL5452072

SCHEMBL5452072

COc1cccc2c(C(=O)NCc3cccc(C)c3)cn(CCCN3[C@@H]4CC[C@H]3CN(CCOc3ccc(F)cc3)C4)c12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 9/20 0.43
CNR2 P34972 8/20 0.42
PTPN7 P35236 1/20 0.39
ADORA2A P29274 1/20 0.37

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
SCHEMBL14412182 1.00 PDE10A (0.43) PDE10ACNR2PTPN7ADORA2A
SCHEMBL14412091 0.94 PDE10A (0.50) PDE10ACNR2PTPN7
SCHEMBL5444386 0.94 PDE10A (0.50) PDE10ACNR2PTPN7
SCHEMBL5446557 0.93 PDE10A (0.39) PDE10ACNR2PTPN7
SCHEMBL14412163 0.93 PDE10A (0.39) PDE10ACNR2PTPN7
SCHEMBL14412081 0.90 CNR2 (0.43) PDE10ACNR2
SCHEMBL5445403 0.90 CNR2 (0.43) PDE10ACNR2
SCHEMBL14412075 0.90 PDE10A (0.45) PDE10ACNR2PTPN7ADORA2A
SCHEMBL5454100 0.90 PDE10A (0.45) PDE10ACNR2PTPN7ADORA2A
SCHEMBL14412106 0.89 PDE10A (0.45) PDE10ACNR2PTPN7

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 106/4885PTPN7 592/4885

“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.