SCHEMBL6248595

SCHEMBL6248595

CCN(CC)C(=O)c1ccc(Cc2ccccc2OCCN2CCC(c3ccccc3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 8/20 0.51
DRD1 P21728 6/20 0.50
DRD5 P21918 5/20 0.50
DRD4 P21917 4/20 0.50
DRD3 P35462 4/20 0.50
DRD2 P14416 3/20 0.49
SLC18A3 Q16572 1/20 0.48
HRH3 Q9Y5N1 1/20 0.46
KDM4E B2RXH2 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LTA4H P09960 2/20 0.43
OPRM1 P35372 2/20 0.43
OPRD1 P41143 2/20 0.43

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
SCHEMBL6248527 0.85 OPRD1 (0.48) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6249856 0.84 HTR7 (0.54) DRD2
SCHEMBL6247229 0.83 HRH1 (0.44) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6248006 0.82 C5AR1 (0.46) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6247365 0.82 DRD2 (0.52) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6246597 0.82 HRH1 (0.44) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6246377 0.82 HRH1 (0.44) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6249521 0.82 HRH1 (0.44) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6247419 0.82 DRD2 (0.48) HRH1DRD1DRD5DRD4DRD3
SCHEMBL6250427 0.81 HRH1 (0.48) HRH1DRD1DRD5DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256575-B1 PHENOXYALKYLAMINE DERIVATIVES USEFUL AS OPIOID DELTA RECEPTOR AGONISTS MEIJI SEIKA KAISHA (JP) 2005-08-17 EP disclosed
US-6916822-B2 Phenoxyalkylamine derivatives useful as opioid δ receptor agonists MEIJI SEIKA KAISHA, LTD. (JP) 2005-07-12 US disclosed
US-20050148583-A1 Phenoxyalkylamine derivatives useful as opioid delta receptor ligands MEIJI SEIKA KAISHA, LTD. (JP) 2005-07-07 US disclosed
US-20030171370-A1 Phenoxyalkylamine derivatives useful as opioid receptor agonists MEIJI SEIKA KAISHA, LTD. (JP) 2003-09-11 US disclosed
EP-1256575-A1 PHENOXYALKYLAMINE DERIVATIVES USEFUL AS OPIOID DELTA RECEPTOR AGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2002-11-13 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 (2 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-20030171370-A1 Phenoxyalkylamine derivatives useful as opioid receptor agonists OPRM1, OPRK1, OPRD1 HRH1 157/4885DRD1 259/4885DRD5 318/4885
US-20050148583-A1 Phenoxyalkylamine derivatives useful as opioid delta receptor ligands OPRD1, OPRM1, OPRK1 HRH1 267/4885DRD1 115/4885DRD5 373/4885

“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.