SCHEMBL5658091

SCHEMBL5658091

O=C1c2ccccc2CN1CC1CCN(CCN2CCN(c3ccccc3)C2=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.55
DRD2 P14416 11/20 0.55
ACHE P22303 1/20 0.52
HTR2A P28223 3/20 0.52
HTR1A P08908 2/20 0.52
TMEM97 Q5BJF2 1/20 0.52
DRD5 P21918 1/20 0.49
KCNH2 Q12809 10/20 0.48
HTR7 P34969 2/20 0.48
DRD4 P21917 1/20 0.48

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
Hydrochloric Acid SCHEMBL5658610 0.99 DRD3 (0.54) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5659084 0.86 ACHE (0.62) DRD3DRD2ACHEHTR2AHTR1A
Hydrochloric Acid SCHEMBL5658146 0.85 ACHE (0.61) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5659080 0.79 DRD3 (0.60) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5660496 0.79 HTR1A (0.62) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5658279 0.79 DRD2 (0.64) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5249614 0.79 ACHE (0.55) DRD3DRD2ACHEHTR2AHTR1A
SCHEMBL5659588 0.79 ALDH1A1 (0.55) DRD3DRD2ACHEHTR2AHTR1A
Hydrochloric Acid SCHEMBL5658186 0.78 DRD3 (0.59) DRD3DRD2ACHEHTR2AHTR1A
Hydrochloric Acid SCHEMBL5656043 0.78 DRD2 (0.62) DRD3DRD2ACHEHTR2AHTR1A

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-7166617-B2 Cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-01-23 US disclosed
US-20030212094-A1 Novel cyclic amide derivatives MITSUBISHI PHARMA CORPORATION (JP) 2003-11-13 US disclosed
EP-1260512-A1 NOVEL CYCLIC AMIDE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2002-11-27 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-20030212094-A1 Novel cyclic amide derivatives SIGMAR1, OPRM1, OPRD1 DRD3 395/4885DRD2 402/4885ACHE 1767/4885

“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.