SCHEMBL3065987

SCHEMBL3065987

CCCCCCCCS(=O)(=O)N1CCN(c2nc(Cc3ccc(C)cc3)ns2)C(C)C1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.35
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
GRM2 Q14416 1/20 0.31
ALDH1A1 P00352 2/20 0.31
USP2 O75604 1/20 0.31
RUVBL2 Q9Y230 1/20 0.31
RUVBL1 Q9Y265 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
GSK3B P49841 1/20 0.31
POLB P06746 1/20 0.30
NAMPT P43490 1/20 0.30
ADAM17 P78536 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
SCHEMBL3059693 1.00 CNR1 (0.35) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3056171 1.00 CNR1 (0.35) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3051301 1.00 CNR1 (0.35) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3054607 0.91 CNR1 (0.39) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3054677 0.90 CNR1 (0.35) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3057938 0.88 CNR1 (0.36) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3055027 0.86 CNR1 (0.44) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL2001119 0.86 CNR1 (0.44) CNR1KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL3055326 0.85 CNR1 (0.35) CNR1LMNASMN1; SMN2CYP3A4
SCHEMBL3063357 0.84 CNR1 (0.40) CNR1LMNASMN1; SMN2ALDH1A1USP2

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 3782/4885KMT2A 1844/4885LMNA 1113/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KMT2A 1844/4885LMNA 1113/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KMT2A 1844/4885LMNA 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.