SCHEMBL2021252

SCHEMBL2021252

CN(CC(=O)NC1CC1)C(=O)c1ccc2[nH]c3c(c2c1)CC(C1CCCCC1)CC3

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.55
CNR2 P34972 3/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.49
HTR1A P08908 2/20 0.48
HTR1B P28222 2/20 0.48
HTR1D P28221 1/20 0.48
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
HTR1E P28566 1/20 0.46
HTR7 P34969 1/20 0.46
OPRM1 P35372 1/20 0.46
TMEM97 Q5BJF2 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL2017142 0.81 CNR1 (0.68) CNR1CNR2SMN1; SMN2HTR1AHTR1B
SCHEMBL2016322 0.77 KMT2A (0.68) CNR1L3MBTL1SMN1; SMN2HTR1AHTR1B
SCHEMBL2019886 0.77 CNR1 (0.67) CNR1CNR2
SCHEMBL2017252 0.77 CNR1 (0.64) CNR1CNR2
SCHEMBL2020454 0.74 KMT2A (0.52) CNR1CNR2L3MBTL1HTR1AHTR1B
SCHEMBL14259955 0.72 CNR1 (0.56) CNR1CNR2L3MBTL1SMN1; SMN2
SCHEMBL2019751 0.72 CNR1 (0.67) CNR1CNR2L3MBTL1SMN1; SMN2HTR1A
SCHEMBL6958366 0.71 HTR1F (0.63) SMN1; SMN2HTR1AHTR1BHTR1DDRD2
SCHEMBL2018744 0.71 CNR1 (1.00) CNR1CNR2
SCHEMBL2018952 0.71 CNR1 (1.00) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
US-20110160180-A1 Cannabinoid Receptor Ligands ASTRAZENECA AB (SE) 2011-06-30 US disclosed
EP-2190838-A1 CANNABINOID RECEPTOR LIGANDS AstraZeneca AB (SE) 2010-06-02 EP disclosed
US-20090062251-A1 Novel Compounds 002 ASTRAZENECA AB (SE) 2009-03-05 US disclosed
US-20090062251-A1 Novel Compounds 002 ASTRAZENECA AB (SE) 2009-03-05 US disclosed
US-20090062251-A1 Novel Compounds 002 ASTRAZENECA AB (SE) 2009-03-05 US disclosed
WO-2009024819-A1 CANNABINOID RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2009-02-26 WO disclosed
WO-2009024819-A1 CANNABINOID RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2009-02-26 WO 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-20090062251-A1 Novel Compounds 002 OPRL1, OPRK1, OPRM1 CNR1 17/4885CNR2 31/4885L3MBTL1 2425/4885
US-20110160180-A1 Cannabinoid Receptor Ligands CNR1, CNR2, OPRL1 CNR1 1/4885CNR2 2/4885L3MBTL1 3001/4885

“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.