SCHEMBL3058433

SCHEMBL3058433

N#Cc1ccc(S(=O)(=O)N2CCCN(c3nc(C(O)c4ccc(Oc5ccccc5)cc4)ns3)CC2)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TRPV4 Q9HBA0 14/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
CYP19A1 P11511 1/20 0.36
GPR6 P46095 1/20 0.35
CHRM4 P08173 2/20 0.34

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
SCHEMBL3066650 0.88 KMT2A (0.46) MAPTKMT2ANPSR1
SCHEMBL3051045 0.88 SCN9A (0.45) MAPTKMT2ANPSR1GPR6
SCHEMBL3065745 0.84 ALDH1A1 (0.43) MAPTKMT2A
SCHEMBL3048997 0.84 DCTPP1 (0.34) MAPTKMT2ANPSR1CHRM4
SCHEMBL3058392 0.83 SMN1; SMN2 (0.45) MAPTKMT2A
SCHEMBL3054766 0.81 POLB (0.40) MAPTKMT2ANPSR1
SCHEMBL3054266 0.80 LMNA (0.34) MAPTKMT2ANPSR1
SCHEMBL3064525 0.80 SMN1; SMN2 (0.42) MAPTKMT2A
SCHEMBL3045937 0.79 ALDH1A1 (0.41) MAPTKMT2ACYP19A1
SCHEMBL3060136 0.78 MAPT (0.43) MAPT

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 MAPT 9/4885KMT2A 1844/4885NPSR1 1776/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAPT 9/4885KMT2A 1844/4885NPSR1 1776/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAPT 9/4885KMT2A 1844/4885NPSR1 1776/4885

“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.