SCHEMBL3058869

SCHEMBL3058869

O=[N+]([O-])c1ccccc1Cc1nsc(N2CCCN(S(=O)(=O)c3ccc(Oc4ccccc4)cc3)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.43
LMNA P02545 5/20 0.43
ALDH1A1 P00352 4/20 0.43
FAAH O00519 1/20 0.42
GPR174 Q9BXC1 1/20 0.42
KMT2A Q03164 4/20 0.40
HSD11B1 P28845 2/20 0.39
MAPK1 P28482 1/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
APP P05067 1/20 0.37

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
SCHEMBL3057483 0.89 HSD11B1 (0.43) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3057085 0.86 MAPT (0.48) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3067129 0.86 HSD11B1 (0.48) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3060337 0.84 GPR174 (0.41) SMN1; SMN2LMNAALDH1A1FAAHGPR174
SCHEMBL3054154 0.84 L3MBTL1 (0.51) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3053402 0.84 ALDH1A1 (0.61) SMN1; SMN2LMNAALDH1A1KMT2AMEN1
SCHEMBL3051687 0.84 GPR174 (0.39) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3065016 0.83 ALDH1A1 (0.39) SMN1; SMN2LMNAALDH1A1GPR174KMT2A
SCHEMBL3045260 0.83 PKM (0.44) ALDH1A1KMT2AHSD11B1MEN1HTT
SCHEMBL3056021 0.82 ALDH1A1 (0.52) SMN1; SMN2LMNAALDH1A1GPR174KMT2A

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 SMN1; SMN2 4/4885LMNA 1113/4885ALDH1A1 1930/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 SMN1; SMN2 4/4885LMNA 1113/4885ALDH1A1 1930/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 SMN1; SMN2 4/4885LMNA 1113/4885ALDH1A1 1930/4885

“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.