SCHEMBL352506

SCHEMBL352506

Cn1nc(C(C)(C)C)cc1C(=O)CNC(=O)C(C)(C)S(=O)(=O)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.42
▸ GRN P28799 1/20 0.42
▸ SORT1 Q99523 1/20 0.42
▸ CACNA1H O95180 1/20 0.39
▸ GALR3 O60755 3/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CNR2 P34972 4/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CTSL P07711 3/20 0.36
▸ CCR8 P51685 1/20 0.35
▸ CTSS P25774 1/20 0.35
▸ CTSK P43235 1/20 0.35
▸ NR2F2 P24468 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ MAPK13 O15264 1/20 0.35
▸ MAPK12 P53778 1/20 0.35
▸ MAPK11 Q15759 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
SCHEMBL352166 0.81 GRN (0.42) KDM4EGRNSORT1CACNA1HGALR3
SCHEMBL1621077 0.80 CNR2 (0.57) LMNACNR2MAPK13MAPK12MAPK11
SCHEMBL1619502 0.79 CNR2 (0.58) LMNACNR2MAPK13MAPK12MAPK11
SCHEMBL353098 0.78 CNR2 (0.49) KDM4EGRNSORT1CACNA1HGALR3
SCHEMBL351695 0.76 CNR2 (0.52) KDM4EGRNSORT1GALR3RAB9A
SCHEMBL352451 0.76 CNR2 (0.66) KDM4EGRNSORT1CNR2CNR1
SCHEMBL4013405 0.75 CNR2 (0.48) LMNACNR2CNR1MAPK13MAPK12
SCHEMBL351307 0.74 CNR2 (0.49) KDM4EGRNSORT1CACNA1HGALR3
SCHEMBL766896 0.70 CNR2 (0.57) LMNACNR2CNR1MAPK13MAPK12
SCHEMBL13545145 0.67 GRN (0.67) KDM4EGRNSORT1GALR3RAB9A

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 6 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
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
US-20120015988-A1 Sulfone Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-19 — — US disclosed
US-20120015988-A1 Sulfone Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-01-19 — — US 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 KDM4E 2157/4885GRN 4810/4885SORT1 2723/4885

“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.

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