SCHEMBL6790045

SCHEMBL6790045

Cc1ccc(C2CCN(CCCCN)CC2)c(O)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 10/20 0.49
DRD3 P35462 9/20 0.49
DRD2 P14416 9/20 0.49
SLC6A4 P31645 1/20 0.48
HTR1A P08908 7/20 0.42
DRD1 P21728 7/20 0.42
DRD5 P21918 7/20 0.42
KCNH2 Q12809 1/20 0.40
CHRM1 P11229 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
HTR7 P34969 1/20 0.38

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
SCHEMBL6790041 0.84 DRD4 (0.59) DRD4DRD3DRD2KDM4EALDH1A1
SCHEMBL6788133 0.84 SLC6A4 (0.46) DRD4DRD3DRD2SLC6A4HTR1A
SCHEMBL3107904 0.81 SLC6A4 (0.44) DRD4DRD3DRD2SLC6A4KDM4E
Hydrochloric Acid SCHEMBL6710614 0.80 SLC6A4 (0.43) DRD4DRD3DRD2SLC6A4KDM4E
SCHEMBL6807738 0.79 HTR1A (0.50) DRD3DRD2HTR1AHTR7
SCHEMBL6199530 0.76 DRD4 (0.45) DRD4DRD3DRD2SLC6A4
SCHEMBL2047774 0.75 TRPA1 (0.50) DRD2SLC6A4DRD1CHRM1KDM4E
SCHEMBL6811422 0.75 DRD2 (0.40) DRD4DRD3DRD2SLC6A4KDM4E
SCHEMBL7653412 0.75 DRD2 (0.52) DRD4DRD3DRD2HTR1ADRD1
SCHEMBL6811433 0.73 DRD4 (0.39) DRD4DRD3DRD2SLC6A4KCNH2

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 9 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
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
EP-1351937-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
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 (2 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 DRD4 118/4885DRD3 117/4885DRD2 152/4885
US-20040072865-A1 Aryl piperidine derivatives as inducers of ldl-receptor expression NR1H2, NR1H3, NR1H4 DRD4 244/4885DRD3 222/4885DRD2 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.