SCHEMBL1021501

SCHEMBL1021501

COc1ccc(S(=O)(=O)N(C)CCNc2nc(Cc3ccc(Cl)cc3)ns2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
CA2 P00918 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
CA9 Q16790 1/20 0.40
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
CNR2 P34972 1/20 0.40
MAPT P10636 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTGER1 P34995 1/20 0.39
CXCR3 P49682 1/20 0.39
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 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
SCHEMBL1019955 0.95 LMNA (0.39) SMN1; SMN2MMP9MAPTALDH1A1HTT
SCHEMBL1020790 0.91 LMNA (0.46) EGFRSMN1; SMN2CNR2MAPTPTGER1
SCHEMBL1021243 0.91 ALDH1A1 (0.44) EGFRERBB2SMN1; SMN2MMP2MMP9
SCHEMBL1021206 0.90 ALDH1A1 (0.42) CA1SMN1; SMN2MMP9CXCR3ALDH1A1
SCHEMBL1018840 0.87 ALDH1A1 (0.39) SMN1; SMN2MMP9MAPTALDH1A1KMT2A
SCHEMBL1020130 0.86 BMP1 (0.42) SMN1; SMN2MAPTALDH1A1KMT2AMEN1
SCHEMBL1021296 0.84 MAPT (0.44) SMN1; SMN2MMP9MAPTALDH1A1KMT2A
SCHEMBL1020720 0.84 MEN1 (0.51) CA1EGFRERBB2SMN1; SMN2KDM1A
SCHEMBL1020922 0.84 MGAT3 (0.41) SMN1; SMN2MAOAMAPTALDH1A1KMT2A
SCHEMBL1020800 0.83 MEN1 (0.54) CA1EGFRERBB2SMN1; SMN2KDM1A

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 CA1 4880/4885EGFR 4814/4885ERBB2 4083/4885

“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.