SCHEMBL3064336

SCHEMBL3064336

CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3nc(Cc4ccc(C)cc4)ns3)CC2C)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
KDM2B Q8NHM5 1/20 0.43
ACHE P22303 3/20 0.40
BCHE P06276 2/20 0.40
CNR1 P21554 1/20 0.40
HSD11B1 P28845 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
HTR6 P50406 1/20 0.37
LPAR1 Q92633 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 2/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL2007602 0.87 LMNA (0.47) ALDH1A1CNR1MAPTKMT2AGAA
SCHEMBL4684219 0.85 MEN1 (0.49) ALDH1A1CNR1MAPTKMT2AGAA
SCHEMBL2007089 0.84 ALDH1A1 (0.42) ALDH1A1ACHECNR1HSD11B1KMT2A
SCHEMBL3063398 0.84 ACHE (0.49) ALDH1A1KDM2BACHEBCHECNR1
SCHEMBL2010440 0.83 PSEN1 (0.42) ALDH1A1ACHECNR1HSD11B1KDM4E
SCHEMBL2000970 0.83 VCAM1 (0.42) ALDH1A1HSD11B1MAPTKDM4EGAA
SCHEMBL3054951 0.82 HSD11B1 (0.43) ALDH1A1CNR1HSD11B1GAATSHR
SCHEMBL3054414 0.82 ALDH1A1 (0.40) ALDH1A1KDM2BACHECNR1HSD11B1
SCHEMBL3065303 0.81 LMNA (0.44) ALDH1A1KDM2BCNR1HSD11B1HTR6
SCHEMBL3052047 0.81 ALDH1A1 (0.40) ALDH1A1ACHECNR1HSD11B1KMT2A

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 ALDH1A1 1930/4885KDM2B 3493/4885ACHE 2964/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 ALDH1A1 1930/4885KDM2B 3493/4885ACHE 2964/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 ALDH1A1 1930/4885KDM2B 3493/4885ACHE 2964/4885

“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.