SCHEMBL6789412

SCHEMBL6789412

C=CCOc1c(C2CCNCC2)ccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.43
SLC6A4 P31645 7/20 0.43
SLC6A3 Q01959 6/20 0.43
HTR1A P08908 4/20 0.43
HTR6 P50406 2/20 0.41
HTR2C P28335 5/20 0.40
HPGD P15428 1/20 0.40
ADRB2 P07550 1/20 0.40
GABRA1 P14867 2/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRB2 P47870 1/20 0.39
MYB P10242 1/20 0.38
HTR3A P46098 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL6783764 0.81 SLC6A4 (0.44) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL5584856 0.78 HTR2C (0.54) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL6791189 0.78 KDM4E (0.46) SLC6A4
SCHEMBL6791223 0.76 SLC6A4 (0.49) SLC6A4HTR6
SCHEMBL6789557 0.74 DRD2 (0.42) SLC6A4HTR6
SCHEMBL20554922 0.73 HPGD (0.48) HPGDMYB
SCHEMBL6784237 0.73 DRD2 (0.43) SLC6A4HTR1AHTR6
SCHEMBL30368566 0.72 HTR2C (0.56) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL2710242 0.72 HTR2C (0.56) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL3816129 0.71 HPGD (0.60) HPGDMYB

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 SLC6A2 2350/4885SLC6A4 969/4885SLC6A3 1568/4885

“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.