SCHEMBL5451130

SCHEMBL5451130

COc1cccc2c(C(=O)Cc3ccccc3)cn(CCCN3CCC(CCOc4ccc(Cl)cc4)CC3)c12

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.51
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HRH3 Q9Y5N1 4/20 0.42
DRD2 P14416 2/20 0.42
DRD4 P21917 2/20 0.42
PAX8 Q06710 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
SCHEMBL5441837 0.91 CNR2 (0.55) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5457594 0.88 MAPT (0.49) CNR2ALDH1A1HRH3
SCHEMBL5457390 0.85 PDE10A (0.48) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5443156 0.85 CNR2 (0.59) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5444353 0.84 CNR2 (0.44) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5452013 0.84 CNR2 (0.46) CNR2HRH3
SCHEMBL5449049 0.82 CNR2 (0.53) CNR2MEN1KMT2AHRH3
SCHEMBL5453735 0.82 CNR2 (0.51) CNR2HRH3
SCHEMBL5446497 0.81 CNR2 (0.45) CNR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL5444360 0.80 TSHR (0.44) MEN1KMT2AHRH3DRD2

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 106/4885MEN1 2039/4885KMT2A 4056/4885

“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.