SCHEMBL3066638

SCHEMBL3066638

O=C1CCC(c2ccccc2)(c2nsc(N3CCN(C(=O)c4ccccc4-c4cccs4)CC3)n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
PLAUR Q03405 1/20 0.41
HCRTR1 O43613 16/20 0.41
HCRTR2 O43614 16/20 0.41
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL3059313 0.86 ABL1 (0.47) LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3064214 0.80 KMT2A (0.41) LMNAKDM4EALDH1A1HTTMAPT
SCHEMBL3060855 0.77 OPRD1 (0.45) LMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3045491 0.77 SLC6A7 (0.44) KDM4EALDH1A1HTTMAPT
SCHEMBL3063959 0.75 GRM5 (0.43) LMNAKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL3061304 0.74 MAPT (0.38) LMNAMAPT
SCHEMBL3068834 0.74 MEN1 (0.41) KDM4E
SCHEMBL3055766 0.74 ALDH1A1 (0.57) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL3063668 0.73 KMT2A (0.46) KDM4EALDH1A1HTTMAPT
SCHEMBL3044774 0.73 MGLL (0.44) LMNAKDM4EALDH1A1MAPTSMN1; 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 LMNA 1113/4885KDM4E 4164/4885ALDH1A1 1930/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 LMNA 1113/4885KDM4E 4164/4885ALDH1A1 1930/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 LMNA 1113/4885KDM4E 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.