SCHEMBL6709239

SCHEMBL6709239

CCOc1cc(C(C)C)ccc1C1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.44
HTR2C P28335 2/20 0.43
SLC6A2 P23975 4/20 0.42
SLC6A4 P31645 4/20 0.42
SLC6A3 Q01959 4/20 0.42
HTR1A P08908 2/20 0.42
TLR9 Q9NR96 2/20 0.41
TLR8 Q9NR97 2/20 0.41
TLR7 Q9NYK1 2/20 0.41
IKBKB O14920 1/20 0.41

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
SCHEMBL6707301 0.84 HTR2C (0.58) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL6709469 0.81 SLC6A2 (0.59) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL5937352 0.81 HTR6 (0.48) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL25085649 0.80 HTR6 (0.43) HTR6HTR2CSLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL15141019 0.79 SLC6A2 (0.54) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL16957023 0.78 SMN1; SMN2 (0.38) HTR6
SCHEMBL6707225 0.77 CHRM4 (0.47)
SCHEMBL5669748 0.76 SLC6A2 (0.68) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL20458024 0.76 HTR2C (0.54) HTR6HTR2CSLC6A2SLC6A4SLC6A3
SCHEMBL15785387 0.75 HTR6 (0.45) HTR6HTR2CSLC6A2SLC6A4SLC6A3

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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-22 US disclosed
EP-1351936-A1 ARYL PIPERIDINE AND PIPERAZINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP disclosed
WO-2002055496-A1 ARYL PIPERIDINE AND PIPERAZINE 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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression LDLR, NR1H2, NCOR1 HTR6 705/4885HTR2C 1120/4885SLC6A2 2604/4885

“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.