SCHEMBL3069440

SCHEMBL3069440

Cc1ccc(NC(=O)N2CCN(c3nc(Cc4ccc(F)cc4)ns3)CC2)cn1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.55
CNR1 P21554 1/20 0.53
ALDH1A1 P00352 3/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TRPV1 Q8NER1 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL28799910 0.87 CNR1 (0.56) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2004940 0.85 FAAH (0.71) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2004435 0.85 FAAH (0.56) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2007441 0.83 FAAH (0.67) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2013559 0.83 CNR1 (0.64) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2006893 0.82 FAAH (0.63) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL2004199 0.80 FAAH (0.66) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL12569101 0.79 CNR1 (0.59) FAAHCNR1ALDH1A1MAPTALOX15
SCHEMBL12569103 0.78 FAAH (0.54) FAAHCNR1ALDH1A1ALOX15SMN1; SMN2
SCHEMBL2005538 0.77 GAA (0.52) FAAHCNR1ALDH1A1MAPTALOX15

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 3782/4885ALDH1A1 1930/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 FAAH 2797/4885CNR1 3782/4885ALDH1A1 1930/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 FAAH 2797/4885CNR1 3782/4885ALDH1A1 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.