SCHEMBL6249474

SCHEMBL6249474

CCN(CC)C(=O)c1ccc(-c2ccccc2O)cc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.68
ALDH1A1 P00352 3/20 0.68
MAPT P10636 1/20 0.68
GAA P10253 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
HSP90AA1 P07900 5/20 0.51
HSP90AB1 P08238 5/20 0.51
OPRD1 P41143 2/20 0.49
KCNH2 Q12809 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
MLYCD O95822 1/20 0.49
CYP1A2 P05177 1/20 0.48
BLM P54132 1/20 0.48
LMNA P02545 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
SCHEMBL4444933 0.81 HPGD (1.00) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL6247420 0.80 HPGD (0.62) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL5703500 0.78 HPGD (0.73) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL9679486 0.78 SMN1; SMN2 (0.65) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL6246322 0.78 HPGD (0.59) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL27523461 0.77 HPGD (0.79) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL72112 0.77 HPGD (0.85) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL6246739 0.75 HSP90AA1 (0.56) HPGDALDH1A1MAPTGAAL3MBTL1
SCHEMBL1806308 0.75 HPGD (0.63) HPGDALDH1A1MAPTL3MBTL1HSP90AA1
Hydrochloric Acid SCHEMBL6612619 0.75 HPGD (0.81) HPGDALDH1A1MAPTGAAL3MBTL1

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 HPGD 2331/4885ALDH1A1 2141/4885MAPT 2335/4885
US-20050148583-A1 Phenoxyalkylamine derivatives useful as opioid delta receptor ligands OPRD1, OPRM1, OPRK1 HPGD 2802/4885ALDH1A1 1810/4885MAPT 2198/4885

“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.