SCHEMBL6789557

SCHEMBL6789557

C=CCOc1c(C2CCN(CCCC(N)=O)CC2)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.42
SLC6A4 P31645 1/20 0.42
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
DRD4 P21917 4/20 0.39
HTR6 P50406 2/20 0.39
HRH3 Q9Y5N1 3/20 0.39
HTR7 P34969 4/20 0.37
NR1H4 Q96RI1 1/20 0.36
GCGR P47871 1/20 0.36

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
SCHEMBL6791223 0.87 SLC6A4 (0.49) DRD2SLC6A4DRD4HTR6HRH3
SCHEMBL6795939 0.85 DRD2 (0.51) DRD2SLC6A4HTR1DHTR1BDRD4
SCHEMBL6724395 0.85 DRD2 (0.49) DRD2SLC6A4HTR1DHTR1BDRD4
SCHEMBL6784237 0.83 DRD2 (0.43) DRD2SLC6A4HTR6HTR7
SCHEMBL6791189 0.81 KDM4E (0.46) DRD2SLC6A4HRH3
SCHEMBL6788939 0.80 DRD2 (0.50) DRD2SLC6A4HTR1DHTR1BDRD4
SCHEMBL6789412 0.74 SLC6A2 (0.43) SLC6A4HTR6
SCHEMBL6784248 0.72 MTNR1A (0.44) DRD2SLC6A4HRH3
SCHEMBL6789060 0.71 SLC6A4 (0.54) DRD2SLC6A4DRD4HTR6HRH3
SCHEMBL3111720 0.71 HRH3 (0.50) DRD2DRD4HTR6HRH3HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147557-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression BOUILLOT ANNE (FR) 2004-07-29 US claimed
EP-1351937-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP claimed
WO-2002055497-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2002-07-18 WO claimed
US-20040147557-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression BOUILLOT ANNE (FR) 2004-07-29 US disclosed
EP-1351937-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION GLAXO GROUP LIMITED (GB) 2003-10-15 EP disclosed
WO-2002055497-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-20040147557-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression NR1H2, NR1H3, NR1H4 DRD2 152/4885SLC6A4 969/4885HTR1D 83/4885

“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.