SCHEMBL1019851

SCHEMBL1019851

O=S(=O)(NCCNc1nc(Cc2ccc(Cl)cc2)ns1)c1cccs1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
MAPT P10636 1/20 0.43
KDM1A O60341 1/20 0.43
PKM P14618 2/20 0.42
NPY5R Q15761 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
CCR1 P32246 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL1019556 0.94 NPY5R (0.46) CYP2D6CYP2C9CYP2C19MAPTKDM1A
SCHEMBL1020397 0.90 CYP2D6 (0.53) CYP2D6CYP2C9CYP2C19MAPTPKM
SCHEMBL1019823 0.90 CYP2D6 (0.50) CYP2D6CYP2C9CYP2C19MAPTPKM
SCHEMBL1020992 0.90 CYP2C9 (0.50) CYP2D6CYP2C9CYP2C19PKMNPY5R
SCHEMBL1020793 0.87 ALDH1A1 (0.48) CYP2D6CYP2C9CYP2C19MAPTPKM
SCHEMBL1019882 0.84 CYP2C9 (0.44) CYP2D6CYP2C9CYP2C19PKMNPY5R
SCHEMBL1023622 0.84 NPY5R (0.51) CYP2D6CYP2C9CYP2C19MAPTPKM
SCHEMBL1021038 0.84 TSHR (0.47) CYP2D6CYP2C9CYP2C19PKMNPY5R
SCHEMBL1019761 0.84 NPY5R (0.46) CYP2D6CYP2C9CYP2C19MAPTPKM
SCHEMBL1020921 0.83 CYP2C9 (0.47) CYP2D6CYP2C9CYP2C19NPY5RTP53

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 CYP2D6 4262/4885CYP2C9 4583/4885CYP2C19 3887/4885

“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.