SCHEMBL352704

SCHEMBL352704

COC(=O)c1cc(C(C)(C)CO[Si](C)(C)C(C)(C)C)no1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.36
CNR2 P34972 4/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 2/20 0.31
TP53 P04637 1/20 0.30
MAPK14 Q16539 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL352786 0.86 HCAR2 (0.42) CNR1CNR2ALDH1A1
SCHEMBL10146309 0.81 MAPK14 (0.43) CNR1CNR2TSHRHTTALDH1A1
SCHEMBL352449 0.78 ALDH1A1 (0.49) CNR2TSHRHTTALDH1A1MAPT
SCHEMBL25793255 0.77 ALDH1A1 (0.45) CNR1CNR2ALDH1A1MAPK14
SCHEMBL30311273 0.76 ALDH1A1 (0.44) CNR1CNR2ALDH1A1MAPK14
SCHEMBL29011042 0.75 CNR1 (0.31) CNR1CNR2
SCHEMBL23966797 0.74
SCHEMBL27871007 0.73 NOTUM (0.41) TSHRHTTALDH1A1MAPTTP53
SCHEMBL352174 0.72 CNR2 (0.39) CNR1CNR2
SCHEMBL23966769 0.70 MAPK14 (0.40) CNR1CNR2ALDH1A1MAPTTP53

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 CNR1 2/4885CNR2 1/4885TSHR 1037/4885

“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.