SCHEMBL4089515

SCHEMBL4089515

CCCNC(=O)c1c(NC(=O)C2C(C)(C)C2(C)C)sc2c1CCC1(C2)OCCO1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.71
PTPN1 P18031 1/20 0.51
CNR1 P21554 4/20 0.49
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL4084325 0.84 PTPN1 (0.71) CNR2PTPN1POLB
SCHEMBL4094976 0.83 CNR2 (1.00) CNR2PTPN1CNR1TP53
SCHEMBL4086551 0.83 KMT2A (0.55) CNR2PTPN1CNR1POLB
SCHEMBL4095565 0.82 CNR2 (0.74) CNR2CNR1CYP1A2CYP2C9TP53
SCHEMBL4084167 0.82 CNR2 (0.74) CNR2CNR1CYP1A2CYP2C9TP53
SCHEMBL4080114 0.79 CNR2 (0.70) CNR2PTPN1CNR1CYP1A2CYP2C9
SCHEMBL4080530 0.78 CNR2 (0.71) CNR2PTPN1CNR1CYP1A2CYP2C9
SCHEMBL4079868 0.76 CNR2 (0.66) CNR2CNR1CYP1A2CYP2C9TP53
SCHEMBL4087139 0.75 CNR2 (0.84) CNR2PTPN1CNR1
SCHEMBL4084889 0.75 CNR2 (0.67) CNR2CNR1CYP1A2CYP2C9TP53

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 2/4885PTPN1 2348/4885CNR1 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.