SCHEMBL6807738

SCHEMBL6807738

Cc1ccc(C2CCN(CCCCN3C(=O)c4ccccc4C3=O)CC2)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.50
MAOB P27338 4/20 0.50
DRD2 P14416 3/20 0.50
DRD3 P35462 2/20 0.50
HTR7 P34969 1/20 0.50
HRH1 P35367 1/20 0.50
HTR2B P41595 1/20 0.50
CHRM2 P08172 1/20 0.47

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
SCHEMBL6806208 0.87 DRD2 (0.51) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6784528 0.84 HTR1A (0.51) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6790045 0.79 DRD4 (0.49) HTR1ADRD2DRD3HTR7
SCHEMBL6811157 0.79 DRD2 (0.45) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6710692 0.79 DRD2 (0.49) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6709174 0.78 DRD2 (0.61) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6790041 0.77 DRD4 (0.59) DRD2DRD3
SCHEMBL6811161 0.77 MAOB (0.42) HTR1AMAOBDRD2DRD3HTR7
SCHEMBL6709241 0.77 HTR1A (0.62) HTR1ADRD2DRD3HTR7
SCHEMBL6709301 0.77 MAOB (0.52) HTR1AMAOBDRD2DRD3HTR7

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040072865-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-15 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-20040072865-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression NR1H2, NR1H3, NR1H4 HTR1A 256/4885MAOB 2742/4885DRD2 269/4885

“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.