SCHEMBL6790827

SCHEMBL6790827

COc1ccc2ccccc2c1C1CCN(CCCCN)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.48
HRH3 Q9Y5N1 2/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
DRD2 P14416 2/20 0.43
TDP1 Q9NUW8 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
SCHEMBL6784248 0.85 MTNR1A (0.44) SLC6A4HRH3MEN1KMT2ADRD2
SCHEMBL6789308 0.84 DRD2 (0.58) MEN1KMT2ADRD2
SCHEMBL6720905 0.81 SLC6A4 (0.54) SLC6A4HRH3MEN1KMT2ADRD2
SCHEMBL7094962 0.78 MAPT (0.56) SLC6A4MEN1KMT2A
Ammonia Solution, Strong SCHEMBL27509223 0.77 MAPT (0.55) SLC6A4MEN1KMT2A
SCHEMBL6710735 0.76 SLC6A4 (0.68) SLC6A4HRH3MEN1KMT2ADRD2
SCHEMBL6529308 0.75 SLC6A4 (0.46) SLC6A4MEN1KMT2A
SCHEMBL6784657 0.75 SLC6A4 (0.57) SLC6A4HRH3DRD2
SCHEMBL8043711 0.74 DRD2 (0.61) SLC6A4MEN1KMT2ACHRM2CHRM4
SCHEMBL8043716 0.74 DRD2 (0.61) SLC6A4MEN1KMT2ACHRM2CHRM4

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 SLC6A4 969/4885HRH3 423/4885MEN1 4787/4885

“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.