SCHEMBL3055673

SCHEMBL3055673

COc1cccc(Cc2nsc(N3CCN(C(=O)Nc4cncn4C)CC3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.51
CNR1 P21554 1/20 0.46
MAPT P10636 6/20 0.46
MAPK1 P28482 5/20 0.46
ALDH1A1 P00352 5/20 0.46
LMNA P02545 4/20 0.46
HTT P42858 4/20 0.46
TP53 P04637 2/20 0.46
GAA P10253 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HTR6 P50406 1/20 0.41

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
SCHEMBL3063843 0.81 FAAH (0.56) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3050967 0.81 FAAH (0.56) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3067175 0.81 FAAH (0.56) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3056905 0.81 FAAH (0.60) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3065676 0.80 FAAH (0.56) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3058864 0.79 FAAH (0.59) FAAHCNR1MAPTMAPK1ALDH1A1
SCHEMBL3045290 0.78 MAPT (0.65) FAAHMAPTMAPK1ALDH1A1LMNA
SCHEMBL2006710 0.78 ALDH1A1 (0.51) FAAHMAPTMAPK1ALDH1A1LMNA
SCHEMBL3058367 0.76 FAAH (0.61) FAAHMAPTMAPK1ALDH1A1LMNA
SCHEMBL3059888 0.76 FAAH (0.45) FAAHCNR1MAPTMAPK1ALDH1A1

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 FAAH 2797/4885CNR1 3782/4885MAPT 9/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 FAAH 2797/4885CNR1 3782/4885MAPT 9/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 FAAH 2797/4885CNR1 3782/4885MAPT 9/4885

“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.