SCHEMBL13618241

SCHEMBL13618241

CCOC[C@H]1CC[C@@H](N2CCC(OCC)(OCC)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.31
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
OPRL1 P41146 1/20 0.30
PKM P14618 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL1134490 1.00 POLB (0.31) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134489 1.00 POLB (0.31) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL13618231 0.95 POLB (0.32) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134411 0.95 POLB (0.32) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134412 0.95 POLB (0.32) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134414 0.91
SCHEMBL13618161 0.83 POLB (0.34) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134410 0.83 POLB (0.34) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134409 0.83 POLB (0.34) POLBOPRM1OPRK1OPRL1PKM
SCHEMBL1134510 0.77 POLB (0.30) POLBOPRM1OPRK1OPRL1

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
WO-2009136850-A1 MUSCARINIC RECEPTOR AGONITS USEFUL IN THE TREATMENT OF PAIN, ALZHEIMER'S DISEASE AND SCHIZOPHRENIA ASTRAZENECA AB (SE) 2009-11-12 WO disclosed
US-20090275574-A1 NOVEL COMPOUNDS-300 ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275574-A1 NOVEL COMPOUNDS-300 ASTRAZENECA AB (SE) 2009-11-05 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-20090275574-A1 NOVEL COMPOUNDS-300 CACNA1A, SCN10A, OPRM1 POLB 3640/4885OPRM1 3/4885OPRK1 5/4885

“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.