SCHEMBL3054677

SCHEMBL3054677

Cc1ccc(Cc2nsc(N3CCN(S(=O)(=O)CCCCl)CC3C)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.35
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
GSK3B P49841 1/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RUVBL2 Q9Y230 1/20 0.31
RUVBL1 Q9Y265 1/20 0.31
CCR6 P51684 1/20 0.31
POLB P06746 1/20 0.31
NAMPT P43490 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
HTR6 P50406 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
SCHEMBL3057938 0.94 CNR1 (0.36) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3065987 0.90 CNR1 (0.35) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3059693 0.90 CNR1 (0.35) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3051301 0.90 CNR1 (0.35) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3056171 0.90 CNR1 (0.35) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3054607 0.89 CNR1 (0.39) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3055326 0.86 CNR1 (0.35) CNR1CYP3A4LMNASMN1; SMN2
SCHEMBL3063357 0.85 CNR1 (0.40) CNR1CYP3A4CYP2D6GSK3BLMNA
SCHEMBL3064293 0.84 CNR1 (0.38) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3054079 0.84 CNR1 (0.37) CNR1CYP3A4CYP2D6GSK3BLMNA

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
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 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 (3 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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885CYP3A4 3900/4885CYP2D6 4399/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885CYP3A4 3900/4885CYP2D6 4399/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885CYP3A4 3900/4885CYP2D6 4399/4885

“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.