SCHEMBL6791189

SCHEMBL6791189

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
BRD4 O60885 1/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
CREBBP Q92793 1/20 0.46
HRH3 Q9Y5N1 1/20 0.41
MAPK1 P28482 1/20 0.41
PDE10A Q9Y233 2/20 0.41
XIAP P98170 1/20 0.40
DRD2 P14416 1/20 0.39
SLC6A4 P31645 1/20 0.39
MTNR1A P48039 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
SCHEMBL6790066 0.84 KDM4E (0.48) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL6707981 0.83 ALDH1A1 (0.53) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL6789557 0.81 DRD2 (0.42) HRH3DRD2SLC6A4
SCHEMBL6789412 0.78 SLC6A2 (0.43) SLC6A4
SCHEMBL6791223 0.77 SLC6A4 (0.49) HRH3DRD2SLC6A4
SCHEMBL6707921 0.76 ALDH1A1 (0.56) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL6784237 0.75 DRD2 (0.43) ALDH1A1DRD2SLC6A4
SCHEMBL10589925 0.68 WDR5 (0.50) KDM4EALDH1A1POLB
SCHEMBL20537238 0.67 HPGD (0.51) KDM4EALDH1A1POLB
SCHEMBL26208674 0.67 HPGD (0.46) POLBMAPK1MTNR1A

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-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 KDM4E 1640/4885BRD4 664/4885ALDH1A1 1002/4885

“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.