SCHEMBL3063151

SCHEMBL3063151

Cc1ccc(Oc2ccc(Cc3nsc(N4CCCN(S(=O)(=O)CC(F)(F)F)CC4)n3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.47
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31
HTR6 P50406 1/20 0.31
PKM P14618 2/20 0.31
HTT P42858 2/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3063159 0.91 CNR1 (0.44) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3055810 0.91 CNR1 (0.49) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3055389 0.91 CNR1 (0.47) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3066927 0.88 CNR1 (0.49) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3064073 0.87 CNR1 (0.46) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3056411 0.86 CNR1 (0.46) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3063892 0.86 CNR1 (0.44) CNR1KDM4EALDH1A1MAPK1HTR6
SCHEMBL3051317 0.86 CNR1 (0.45) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3060133 0.85 CNR1 (0.46) CNR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL3055711 0.85 CNR1 (0.43) CNR1KDM4EALDH1A1MAPK1

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 CNR1 3782/4885KDM4E 4164/4885ALDH1A1 1930/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KDM4E 4164/4885ALDH1A1 1930/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KDM4E 4164/4885ALDH1A1 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.