SCHEMBL6790516

SCHEMBL6790516

CC1(C)CC12C(=O)Nc1ccc(CCN3CCN(c4nsc5ccccc45)CC3)cc12

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 12/20 0.60
DRD2 P14416 11/20 0.60
KCNH2 Q12809 11/20 0.60
HTR2A P28223 10/20 0.60
HTR7 P34969 1/20 0.60

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
SCHEMBL6795599 0.95 HTR1A (0.54) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL5767939 0.91 HTR1A (0.62) HTR1ADRD2KCNH2HTR2AHTR7
Hydrochloric Acid SCHEMBL4881899 0.89 HTR1A (0.60) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL5678980 0.86 HTR1A (0.61) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL6204580 0.86 HTR2A (0.68) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL9367637 0.85 HTR1A (0.60) HTR1ADRD2KCNH2HTR2AHTR7
Hydrochloric Acid SCHEMBL4891136 0.85 HTR1A (0.59) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL6795579 0.85 HTR1A (0.59) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL9367264 0.84 HTR1A (0.58) HTR1ADRD2KCNH2HTR2AHTR7
SCHEMBL6224447 0.84 HTR2A (0.60) HTR1ADRD2KCNH2HTR2AHTR7

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-20040142933-A1 Oxindole substituted piperazine derivatives FORREST GEORGE WILLIAM (CA) 2004-07-22 US claimed
US-20040142933-A1 Oxindole substituted piperazine derivatives FORREST GEORGE WILLIAM (CA) 2004-07-22 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-20040142933-A1 Oxindole substituted piperazine derivatives OPRK1, OPRD1, CNR1 HTR1A 13/4885DRD2 21/4885KCNH2 1205/4885

“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.