SCHEMBL1021737

SCHEMBL1021737

COc1ccc(S(=O)(=O)NCCNc2nc(Cc3cccc(F)c3)ns2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
CYP19A1 P11511 1/20 0.47
POLB P06746 1/20 0.46
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
TP53 P04637 1/20 0.42
SGMS1 Q86VZ5 1/20 0.41
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP14 P50281 1/20 0.41
ADAM17 P78536 1/20 0.41
DGAT1 O75907 1/20 0.41
MGAT3 Q09327 1/20 0.41
MGAT2 Q10469 1/20 0.41
HTR7 P34969 2/20 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
SCHEMBL1019901 0.94 RAF1 (0.47) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1020309 0.91 CYP19A1 (0.49) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1018423 0.90 LMNA (0.52) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1019414 0.88 ALDH1A1 (0.58) ALDH1A1POLBMAPTSMN1; SMN2PKM
SCHEMBL1019565 0.88 ALDH1A1 (0.57) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1018422 0.87 ALDH1A1 (0.54) ALDH1A1CYP19A1POLBSMN1; SMN2LMNA
SCHEMBL1020037 0.87 ALDH1A1 (0.50) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1021202 0.86 ALDH1A1 (0.46) ALDH1A1POLBMAPTSMN1; SMN2LMNA
SCHEMBL1020922 0.85 MGAT3 (0.41) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2
SCHEMBL1021100 0.84 CYP19A1 (0.44) ALDH1A1CYP19A1POLBMAPTSMN1; SMN2

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 ALDH1A1 608/4885CYP19A1 4749/4885POLB 2907/4885

“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.