SCHEMBL5457584

SCHEMBL5457584

O=C(NCCCN1CCCCC1)N1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.66
DRD3 P35462 11/20 0.66
DRD4 P21917 5/20 0.58
ADRA1A P35348 2/20 0.53
SMYD2 Q9NRG4 1/20 0.53
SLC6A4 P31645 3/20 0.53
SLC6A2 P23975 2/20 0.53

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
SCHEMBL5477260 0.88 DRD2 (0.58) DRD2DRD3ADRA1ASMYD2
SCHEMBL14372243 0.88 DRD3 (0.57) DRD2DRD3DRD4SMYD2SLC6A4
SCHEMBL5457389 0.84 DRD2 (0.73) DRD2DRD3DRD4ADRA1ASLC6A4
SCHEMBL5470996 0.84 DRD2 (0.57) DRD2DRD3DRD4ADRA1A
SCHEMBL5468384 0.82 DRD2 (0.62) DRD2DRD3DRD4SLC6A4
SCHEMBL5457536 0.81 DRD2 (0.60) DRD2DRD3
SCHEMBL5471037 0.80 SMYD2 (0.55) DRD2DRD3SMYD2
SCHEMBL5470711 0.80 LMNA (0.48) DRD2DRD3SMYD2
SCHEMBL16464148 0.79 DRD3 (1.00) DRD2DRD3DRD4
SCHEMBL5466569 0.78 MAPT (0.52) DRD2DRD3DRD4ADRA1A

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-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 US disclosed
US-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression ASTRAZENECA AB (SE) 2007-10-25 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-20070249618-A1 Novel Piperidine Derivatives as Histamine H3 Receptor Ligands for Treatment of Depression HRH3, HRH1, HRH4 DRD2 34/4885DRD3 78/4885DRD4 101/4885

“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.