SCHEMBL4086661

SCHEMBL4086661

Cc1sc(NC(=O)C2C(C)(C)C2(C)C)c(C(=O)NCCCCO)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.45
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 4/20 0.39
POLB P06746 2/20 0.39
AIP O00170 1/20 0.39
SGTA O43765 1/20 0.39
TOMM70 O94826 1/20 0.39
STIP1 P31948 1/20 0.39
PPP5C P53041 1/20 0.39
FKBP4 Q02790 1/20 0.39
PPID Q08752 1/20 0.39
FKBP5 Q13451 1/20 0.39
FKBP8 Q14318 1/20 0.39
TOMM34 Q15785 1/20 0.39
DNAJC7 Q99615 1/20 0.39
AIPL1 Q9NZN9 1/20 0.39
STUB1 Q9UNE7 1/20 0.39
ALDH1A1 P00352 10/20 0.38
GAA P10253 2/20 0.38

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
SCHEMBL4090499 0.96 CNR2 (0.46) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4080504 0.90 CNR2 (0.50) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4092577 0.89 CNR2 (0.51) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4084751 0.86 CNR2 (0.58) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4084928 0.86 CNR2 (0.43) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4085526 0.84 CNR2 (0.47) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4080989 0.83 CNR2 (0.46) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4091207 0.83 CNR2 (0.45) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4085496 0.83 CNR2 (0.45) CNR2CYP1A2CYP2D6MAPTPOLB
SCHEMBL4086207 0.83 CNR2 (0.46) CNR2CYP1A2CYP2D6MAPTPOLB

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 2/4885CYP1A2 847/4885CYP2D6 1121/4885

“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.