SCHEMBL1020798

SCHEMBL1020798

CCN(CCN(CC)S(=O)(=O)c1ccc(OC)cc1)c1nc(Cc2ccccc2)ns1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.51
CNR1 P21554 3/20 0.51
TAS2R14 Q9NYV8 4/20 0.42
PTGES O14684 1/20 0.42
TAS2R8 Q9NYW2 1/20 0.42
CXCR3 P49682 1/20 0.42
LMNA P02545 3/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
BMP1 P13497 2/20 0.41
MMP3 P08254 1/20 0.41

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
SCHEMBL1020990 0.95 CNR2 (0.46) CNR2CNR1TAS2R14LMNAHTT
SCHEMBL1021017 0.91 CNR2 (0.47) CNR2CNR1TAS2R14LMNAALDH1A1
SCHEMBL2007217 0.91 TAS2R14 (0.44) CNR2CNR1TAS2R14ALDH1A1BMP1
SCHEMBL1021520 0.91 CNR2 (0.48) CNR2CNR1TAS2R14CXCR3ALDH1A1
SCHEMBL2003759 0.90 CNR2 (0.43) CNR2CNR1TAS2R14LMNABMP1
SCHEMBL1020236 0.89 CNR2 (0.42) CNR2CNR1TAS2R14LMNAALDH1A1
SCHEMBL1020376 0.88 TAS2R14 (0.42) CNR2CNR1TAS2R14LMNAHTT
SCHEMBL2008691 0.88 TAS2R14 (0.42) CNR2CNR1TAS2R14LMNAHTT
SCHEMBL2004786 0.87 CNR2 (0.41) CNR2CNR1TAS2R14LMNAHTT
SCHEMBL1018495 0.85 CNR2 (0.39) CNR2CNR1TAS2R14LMNABMP1

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
US-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US claimed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP claimed
US-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2010-06-10 US claimed
US-7960556-B2 Thiadiazole derivatives for the treatment of neuro-degenerative diseases NV REMYND (BE) 2011-06-14 US disclosed
EP-2094677-B1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES REMYND NV (BE) 2011-01-12 EP disclosed
US-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2010-06-10 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-20100144709-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES SNCA, PARK7, PRNP CNR2 3443/4885CNR1 3094/4885TAS2R14 1979/4885

“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.