SCHEMBL6080189

SCHEMBL6080189

O=C1CCc2ccc(CO)nc2N1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
DRD2 P14416 15/20 0.42
HTR1A P08908 14/20 0.42
HTR2A P28223 14/20 0.42
CCR1 P32246 1/20 0.37
NPC1 O15118 1/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGAV P06756 1/20 0.37
CA9 Q16790 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
SCHEMBL18194093 0.83 PDE3B (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL24664739 0.78 DRD2 (0.49) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL14984332 0.78 MAOA (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL4148301 0.74 PDE3B (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL21671865 0.74 PDE3B (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL5366571 0.74 CA9 (0.47) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL4132924 0.74 PDE3B (0.50) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL5371747 0.74 PDE3B (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL18202413 0.74 PDE3B (0.43) PDE3BPDE3ADRD2HTR1AHTR2A
SCHEMBL5316288 0.73 CRBN (0.41) PDE3BPDE3ADRD2HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 US 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-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG PDE3B 2564/4885PDE3A 2995/4885DRD2 2756/4885

“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.