SCHEMBL3779338

SCHEMBL3779338

CCOC(=O)C(C)(C)S(=O)(=O)NC1CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
PDE4B Q07343 6/20 0.35
POLB P06746 1/20 0.34
CHRM1 P11229 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
RECQL P46063 1/20 0.32
CCR8 P51685 1/20 0.32

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
SCHEMBL3788932 0.90 POLB (0.41) MAPTPOLBTSHRALDH1A1LMNA
SCHEMBL3782901 0.87 LMNA (0.44) MAPTTSHRALDH1A1LMNACCR8
SCHEMBL3783558 0.85 LMNA (0.46) MAPTTSHRALDH1A1LMNACCR8
SCHEMBL3784661 0.79 CNR2 (0.33) TSHRALDH1A1LMNA
SCHEMBL766710 0.78 CNR2 (0.41) MAPTPOLBTSHRALDH1A1LMNA
SCHEMBL766875 0.75 CNR2 (0.43) MAPTPOLBTSHRALDH1A1LMNA
SCHEMBL766791 0.74 GPR119 (0.34) MAPTPOLBTSHRALDH1A1LMNA
SCHEMBL10171781 0.70 CNR2 (0.38) MAPTTSHR
SCHEMBL3778580 0.70 MAPT (0.35) MAPTPDE4BCHRM1TSHRALDH1A1
SCHEMBL10171784 0.70 CNR2 (0.38) MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546563-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 US disclosed
US-8546563-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 US disclosed
US-8546563-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 US disclosed
EP-2217565-B1 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2013-05-22 EP disclosed
US-20100331304-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-30 US disclosed
US-20100331304-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-30 US disclosed
US-20100331304-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-30 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-20100331304-A1 Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 MAPT 3638/4885PDE4B 768/4885POLB 4500/4885

“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.