SCHEMBL5899888

SCHEMBL5899888

c1ccc(COc2c(C3CCNCC3)ccc3c2CCCC3)cc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.62
SLC6A4 P31645 8/20 0.62
SLC6A3 Q01959 8/20 0.62
HTR1A P08908 6/20 0.62
HTR6 P50406 6/20 0.42
ALOX5AP P20292 3/20 0.41
FEN1 P39748 3/20 0.41
PRMT5 O14744 1/20 0.41
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 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
SCHEMBL6709392 0.81 FEN1 (0.43) SLC6A2SLC6A4SLC6A3HTR1AALOX5AP
SCHEMBL6794310 0.79 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL5899901 0.79 ENPP2 (0.46) SLC6A2SLC6A4SLC6A3HTR1APRMT5
SCHEMBL5937367 0.78 HTR2C (0.45) SLC6A2SLC6A4SLC6A3HTR1AALOX5AP
SCHEMBL5899843 0.77 ADRA1D (0.45) SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL5899905 0.75 S1PR5 (0.46) HTR6RXRARXRBRXRG
SCHEMBL5899861 0.74 DRD2 (0.48) HTR1A
SCHEMBL5899857 0.73 MEN1 (0.36) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL23228732 0.72 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL21806587 0.72 MAOA (0.46) RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122432-A1 Aryl piperidine derivatives and use thereof to reduce elevated levels of ldl-cholesterol GLAXO GROUP LIMITED (GB) 2006-06-08 US disclosed
EP-1534280-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2005-06-01 EP disclosed
WO-2004006923-A1 ARYL PIPERIDINE DERIVATIVES AS INDUCERS OF LDL-RECEPTOR EXPRESSION FOR THE TREATMENT OF HYPERCHOLESTEROLEMIA GLAXO GROUP LIMITED (GB) 2004-01-22 WO disclosed
WO-2004006924-A1 ARYL PIPERIDINE DERIVATIVES AND USE THEREOF TO REDUCE ELEVATED LEVELS OF LDL-CHOLESTEROL GLAXO GROUP LIMITED (GB) 2004-01-22 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-20060122432-A1 Aryl piperidine derivatives and use thereof to reduce elevated levels of ldl-cholesterol LDLR, NR1H2, NR1H3 SLC6A2 3311/4885SLC6A4 2596/4885SLC6A3 3533/4885

“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.