SCHEMBL4089737

SCHEMBL4089737

CCOC(=O)c1c(NC(=O)C2C(C)(C)C2(C)C)sc2ccccc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 1/20 0.72
CDK2 P24941 1/20 0.72
MAPKAPK2 P49137 1/20 0.72
GSK3B P49841 1/20 0.72
RPS6KA3 P51812 1/20 0.72
MAPT P10636 7/20 0.49
LMNA P02545 4/20 0.49
ALOX12 P18054 1/20 0.49
KDM4E B2RXH2 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
TP53 P04637 3/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ABCC1 P33527 1/20 0.45
ABCG2 Q9UNQ0 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
SCHEMBL12903924 0.86 MAPT (0.60) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL4094794 0.84 RPS6KB1 (1.00) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL5165684 0.84 MAPT (0.67) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL4094953 0.82 RPS6KB1 (0.50) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL11924594 0.81 MAPT (0.52) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL14222025 0.81 ACACB (0.59) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL4091140 0.80 RPS6KB1 (0.49) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL4086750 0.80 CNR2 (0.53) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL3498457 0.80 ABCC1 (0.57) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3
SCHEMBL4084437 0.80 RPS6KB1 (0.47) RPS6KB1CDK2MAPKAPK2GSK3BRPS6KA3

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 RPS6KB1 780/4885CDK2 645/4885MAPKAPK2 2195/4885

“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.