SCHEMBL350411

SCHEMBL350411

CC(C)(C)c1cc(C(N)=NNC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)on1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.53
CNR1 P21554 6/20 0.53
MAPK14 Q16539 3/20 0.42
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL10146272 1.00 CNR2 (0.53) CNR2CNR1MAPK14CA1CA2
SCHEMBL1465550 0.77 CNR2 (0.67) CNR2CNR1MAPK14
SCHEMBL351648 0.70 CNR2 (0.46) CNR2CNR1MAPK14
SCHEMBL469406 0.70 CNR2 (1.00) CNR2CNR1MAPK14
SCHEMBL3962734 0.69 CNR2 (0.91) CNR2CNR1MAPK14
SCHEMBL352123 0.69 CNR2 (0.58) CNR2CNR1CA1CA2CA4
SCHEMBL1464877 0.69 CNR2 (1.00) CNR2CNR1
SCHEMBL1464188 0.68 CNR2 (0.63) CNR2CNR1
SCHEMBL1464930 0.67 CNR2 (0.60) CNR2CNR1MAPK14
SCHEMBL10171346 0.67 CNR2 (0.60) CNR2CNR1MAPK14

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
EP-2418207-A1 Sulfone compounds which modulate the CB2 receptor Boehringer Ingelheim International GmbH (DE) 2012-02-15 EP disclosed
US-20120015988-A1 Sulfone Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-19 US disclosed
EP-2283001-A2 SULFONE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR Boehringer Ingelheim International GmbH (DE) 2011-02-16 EP disclosed
WO-2009140089-A2 SULFONE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-19 WO 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-20120015988-A1 Sulfone Compounds Which Modulate The CB2 Receptor CNR2, CNR1, TRPV1 CNR2 1/4885CNR1 2/4885MAPK14 1347/4885

“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.