SCHEMBL4091613

SCHEMBL4091613

CCCNC(=O)c1c(NC(=O)C2(C)CCCCC2)sc2c1CCOC2

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.71
CNR1 P21554 4/20 0.65
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
ANO1 Q5XXA6 1/20 0.46
PTPRC P08575 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPRB P23467 1/20 0.44
PTPRE P23469 1/20 0.44

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
SCHEMBL4094765 0.84 CNR2 (0.62) CNR2CNR1TP53ANO1
SCHEMBL4089799 0.84 PTPN1 (0.62) CNR2CNR1TP53PTPRCPTPN2
SCHEMBL4094976 0.83 CNR2 (1.00) CNR2CNR1TP53ANO1PTPRC
SCHEMBL4090095 0.83 CNR2 (0.63) CNR2CNR1TP53ANO1
SCHEMBL4090091 0.83 CNR2 (0.60) CNR2CNR1TP53ANO1
SCHEMBL4090464 0.83 CNR2 (0.53) CNR2CNR1CYP1A2
SCHEMBL4095700 0.82 CNR2 (1.00) CNR2CNR1
SCHEMBL4080538 0.82 CNR2 (0.71) CNR2CNR1TP53ANO1
SCHEMBL4085914 0.82 CNR2 (0.80) CNR2CNR1TP53ANO1
SCHEMBL4091575 0.80 CNR2 (0.62) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338623-B2 N-{3-[(2,5-dimethylmorpholin-4-yl)carbonyl]-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl}hexahydro-2,5-methanopentalene-3a(1H)-carboxamide; CB2 receptors ligand; antiinflammatory, analgesic agent; autoimmune diseases; neuroprotectants ABBVIE INC. (US) 2012-12-25 US disclosed
US-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2009-01-15 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-20090018114-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, GPR18 CNR2 2/4885CNR1 1/4885TP53 4856/4885

“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.