SCHEMBL6811058

SCHEMBL6811058

CCc1ccc(C2CCN(CCCCN3C(=O)c4ccccc4C3=O)CC2)c(OP(=O)(O)OC(C)CC)c1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.42
DRD2 P14416 2/20 0.41
HTR4 Q13639 2/20 0.40
HTR1A P08908 3/20 0.39

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
SCHEMBL6811161 0.92 MAOB (0.42) MAOBDRD2HTR4HTR1A
SCHEMBL6811489 0.86 SLC6A4 (0.36) DRD2HTR4HTR1A
SCHEMBL6811053 0.83 DRD2 (0.45) DRD2HTR1A
SCHEMBL6710778 0.81 DRD2 (0.58) DRD2HTR1A
SCHEMBL5937286 0.81 HTR1A (0.51) DRD2HTR1A
SCHEMBL6806208 0.79 DRD2 (0.51) MAOBDRD2HTR1A
SCHEMBL6787753 0.78 DRD2 (0.47) DRD2HTR1A
SCHEMBL6811433 0.78 DRD4 (0.39) DRD2
SCHEMBL6797318 0.76 DRD2 (0.45) DRD2HTR1A
SCHEMBL6802933 0.75 SLC2A1 (0.44) DRD2

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-20040072865-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-15 US disclosed
EP-1351935-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP disclosed
WO-2002055495-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2002-07-18 WO 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 MAOB 2742/4885DRD2 269/4885HTR4 177/4885

“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.