SCHEMBL2162483

SCHEMBL2162483

CCCNC(=O)c1c(NC(=O)c2c(F)cccc2C(F)(F)F)sc2c1C(C)(C)OC2(C)C

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.63
CNR1 P21554 8/20 0.53
TRPA1 O75762 3/20 0.40
CYP1A2 P05177 1/20 0.40
ITGB1 P05556 2/20 0.37
ITGA4 P13612 2/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX2 P34913 1/20 0.34

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
SCHEMBL2162122 0.93 CNR2 (0.54) CNR2CNR1TRPA1CYP1A2ITGB1
SCHEMBL2162521 0.92 CNR2 (0.53) CNR2CNR1TRPA1CYP1A2ITGB1
SCHEMBL2162161 0.91 CNR2 (0.64) CNR2CNR1ITGB1ITGA4
SCHEMBL2162447 0.91 CNR2 (0.53) CNR2CNR1TRPA1CYP1A2ITGB1
SCHEMBL2163190 0.89 CNR2 (0.50) CNR2CNR1ITGB1ITGA4MEN1
SCHEMBL2163253 0.89 CNR2 (0.50) CNR2CNR1TRPA1ITGB1ITGA4
SCHEMBL2162163 0.88 CNR2 (0.49) CNR2CNR1TRPA1ITGB1ITGA4
SCHEMBL2162495 0.86 CNR2 (0.64) CNR2CNR1
SCHEMBL2162105 0.86 CNR2 (0.48) CNR2CNR1TRPA1ITGB1ITGA4
SCHEMBL2162206 0.86 CNR2 (0.48) CNR2CNR1TRPA1ITGB1ITGA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7985768-B2 2-carbonylamino-4,6-dihydrothieno[2,3-c]furans such as ethyl 2-{[2-fluoro-6-(trifluoromethyl)benzoyl]amino}-4-methyl-4,6-dihydrothieno[2,3-c]furan-3-carboxylate; CB2 receptors ligands for immune and inflammatory conditions; pain; neuroprotectants ABBOTT LABORATORIES (US) 2011-07-26 US claimed
US-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 US claimed
US-7985768-B2 2-carbonylamino-4,6-dihydrothieno[2,3-c]furans such as ethyl 2-{[2-fluoro-6-(trifluoromethyl)benzoyl]amino}-4-methyl-4,6-dihydrothieno[2,3-c]furan-3-carboxylate; CB2 receptors ligands for immune and inflammatory conditions; pain; neuroprotectants ABBOTT LABORATORIES (US) 2011-07-26 US disclosed
US-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-03-06 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-20080058308-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, OPRL1 CNR2 2/4885CNR1 1/4885TRPA1 133/4885

“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.