SCHEMBL5201830

SCHEMBL5201830

O=C(O)N1CC[C@@H](N2CCC(N3C(=O)C[C@H]4CCCC[C@@H]43)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 12/20 0.38
L3MBTL1 Q9Y468 9/20 0.38
OPRM1 P35372 4/20 0.38
OPRL1 P41146 4/20 0.38
OPRK1 P41145 1/20 0.38
MBTD1 Q05BQ5 5/20 0.36
LMNA P02545 1/20 0.33
TP53BP1 Q12888 1/20 0.33
L3MBTL4 Q8NA19 1/20 0.33
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL8224025 1.00 L3MBTL3 (0.38) L3MBTL3L3MBTL1OPRM1OPRL1OPRK1
SCHEMBL5204555 1.00 L3MBTL3 (0.38) L3MBTL3L3MBTL1OPRM1OPRL1OPRK1
SCHEMBL8221542 0.83 CHRM1 (0.45) L3MBTL1OPRM1OPRL1GAA
SCHEMBL1929499 0.83 CHRM1 (0.45) L3MBTL1OPRM1OPRL1GAA
SCHEMBL1928769 0.83 CHRM1 (0.45) L3MBTL1OPRM1OPRL1GAA
SCHEMBL12547129 0.83 OPRM1 (0.40) L3MBTL3L3MBTL1OPRM1OPRL1OPRK1
SCHEMBL3409132 0.80 L3MBTL3 (0.36) L3MBTL3L3MBTL1OPRM1OPRL1OPRK1
SCHEMBL1928713 0.78 CHRM2 (0.42) L3MBTL3OPRM1OPRL1OPRK1MBTD1
SCHEMBL1929516 0.78 OPRM1 (0.45) OPRM1OPRK1
SCHEMBL1929062 0.78 CHRM1 (0.53) L3MBTL1OPRM1OPRL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7956069-B2 Compounds ASTRAZENECA AB (SE) 2011-06-07 US disclosed
WO-2007142583-A1 MUSCARINIC RECEPTOR AGONISTS THAT ARE EFFECTIVE IN THE TREATMENT OF PAIN, ALZHEIMER'S DISEASE AND SCHIZOPHRENIA. ASTRAZENECA AB (SE) 2007-12-13 WO disclosed
US-20070287695-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-12-13 US disclosed
US-20070287695-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-12-13 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-20070287695-A1 Novel Compounds OPRM1, OPRL1, OPRK1 L3MBTL3 1341/4885L3MBTL1 1464/4885OPRM1 1/4885

“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.