SCHEMBL3054879

SCHEMBL3054879

Cc1ccc(Cc2nsc(N3CCN(S(=O)(=O)C4CCCC4)CC3C)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.39
CHRM4 P08173 1/20 0.38
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
RUVBL2 Q9Y230 1/20 0.33
RUVBL1 Q9Y265 1/20 0.33
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 1/20 0.32
GSK3B P49841 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
NAMPT P43490 1/20 0.32
MAPT P10636 1/20 0.32
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 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
SCHEMBL3061323 0.99 CHRM4 (0.39) CNR1CHRM4LMNASMN1; SMN2RUVBL2
SCHEMBL3046093 0.96 CNR1 (0.38) CNR1CHRM4LMNASMN1; SMN2RUVBL2
SCHEMBL3054607 0.88 CNR1 (0.39) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3063230 0.86 CNR1 (0.48) CNR1CHRM4SMN1; SMN2CYP3A4MEN1
SCHEMBL3050123 0.85 CNR1 (0.41) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3055859 0.85 CNR1 (0.47) CNR1CHRM4CYP3A4MEN1CYP2C9
SCHEMBL3054079 0.84 CNR1 (0.37) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3057938 0.83 CNR1 (0.36) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3063357 0.83 CNR1 (0.40) CNR1LMNASMN1; SMN2RUVBL2RUVBL1
SCHEMBL3064293 0.83 CNR1 (0.38) CNR1LMNASMN1; SMN2RUVBL2RUVBL1

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 3782/4885CHRM4 4734/4885LMNA 1113/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885CHRM4 4734/4885LMNA 1113/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885CHRM4 4734/4885LMNA 1113/4885

“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.