SCHEMBL3066650

SCHEMBL3066650

N#Cc1ccc(S(=O)(=O)N2CCCN(c3nc(C(O)c4ccc(Oc5ccccc5)cc4)ns3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 1/20 0.42
SCN9A Q15858 2/20 0.42
GBA1 P04062 2/20 0.42
LMNA P02545 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HSD11B1 P28845 1/20 0.37
MMP8 P22894 2/20 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
SCHEMBL3058392 0.93 SMN1; SMN2 (0.45) KMT2AMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL3051045 0.91 SCN9A (0.45) KMT2AMAPTNPSR1L3MBTL1SCN9A
SCHEMBL3064525 0.89 SMN1; SMN2 (0.42) KMT2AMAPTGBA1LMNASMN1; SMN2
SCHEMBL3058433 0.88 MAPT (0.40) KMT2AMAPTNPSR1
SCHEMBL3060136 0.87 MAPT (0.43) MAPTGAAGBA1LMNASMN1; SMN2
SCHEMBL3054766 0.86 POLB (0.40) KMT2AMAPTNPSR1GAALMNA
SCHEMBL3054778 0.85 MAPT (0.49) KMT2AMAPTNPSR1GAALMNA
SCHEMBL3051116 0.84 L3MBTL1 (0.51) KMT2AL3MBTL1LMNASMN1; SMN2ALDH1A1
SCHEMBL3058041 0.84 PTGDR (0.41) KMT2AMAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL3048997 0.84 DCTPP1 (0.34) KMT2AMAPTNPSR1LMNASMN1; 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 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 KMT2A 1844/4885MAPT 9/4885NPSR1 1776/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KMT2A 1844/4885MAPT 9/4885NPSR1 1776/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KMT2A 1844/4885MAPT 9/4885NPSR1 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.