SCHEMBL6249335

SCHEMBL6249335

CCN(CC)C(=O)c1cccc(Cc2ccccc2OC(C)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HPGD P15428 6/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 4/20 0.46
PPARG P37231 1/20 0.46
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 2/20 0.41
MAPT P10636 2/20 0.41
CYP1A2 P05177 1/20 0.41
BLM P54132 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL6246721 0.86 ALDH1A1 (0.53) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6248553 0.78 ALDH1A1 (0.52) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6246924 0.78 HPGD (0.54) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL531084 0.77 PTGS2 (0.54) LMNASMN1; SMN2HPGDTDP1ALDH1A1
SCHEMBL6246569 0.76 POLB (0.48) LMNANPC1RAB9ASMN1; SMN2TDP1
SCHEMBL6249353 0.76 MEN1 (0.56) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6246898 0.75 HPGD (0.48) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL6247319 0.74 HPGD (0.60) LMNASMN1; SMN2HPGDTDP1ALDH1A1
SCHEMBL8828473 0.74 HPGD (0.67) LMNANPC1RAB9ASMN1; SMN2HPGD
SCHEMBL5394414 0.73 AKT1 (0.52) LMNARAB9AHPGDTDP1ALDH1A1

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 LMNA 2796/4885NPC1 1429/4885RAB9A 1044/4885
US-20050148583-A1 Phenoxyalkylamine derivatives useful as opioid delta receptor ligands OPRD1, OPRM1, OPRK1 LMNA 2076/4885NPC1 1448/4885RAB9A 1404/4885

“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.