SCHEMBL5457355

SCHEMBL5457355

CN(C)CCSc1cc[c]s1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 13/20 0.41
HTR1A P08908 6/20 0.38
HTR2A P28223 5/20 0.38
DRD2 P14416 3/20 0.38
SLC6A4 P31645 1/20 0.37
SERPINE1 P05121 2/20 0.35

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
SCHEMBL972804 0.72 HTR7 (0.43) HTR7HTR1AHTR2ADRD2
SCHEMBL14363101 0.69 SERPINE1 (0.45) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL10531206 0.68 SLC6A4 (0.50) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL8624418 0.65 SERPINE1 (0.54) HTR7HTR1AHTR2ADRD2SERPINE1
SCHEMBL12574466 0.63 HTR7 (0.46) HTR7HTR1AHTR2ADRD2SERPINE1
SCHEMBL10534853 0.63 HTR7 (0.42) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL8588324 0.63 SLC6A4 (0.58) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL5174350 0.63 ALDH1A1 (0.61) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL2666854 0.62 CDK2 (0.46) HTR7HTR1AHTR2ADRD2SLC6A4
SCHEMBL12693414 0.61 SLC6A4 (0.56) HTR7HTR1AHTR2ADRD2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 HTR7 2124/4885HTR1A 484/4885HTR2A 2176/4885

“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.