SCHEMBL3066941

SCHEMBL3066941

COC(=O)c1ccc(C(=O)N2CCN(c3nc(Cc4ccc(F)cc4)ns3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.45
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
FAAH O00519 3/20 0.43
MAPK8 P45983 1/20 0.43
MAPK10 P53779 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 3/20 0.42
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALOX15 P16050 1/20 0.41
HTT P42858 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SLC6A7 Q99884 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
SCHEMBL2007046 0.89 CNR1 (0.53) CNR1KMT2AMEN1L3MBTL1KDM4E
SCHEMBL2009579 0.89 CNR1 (0.53) CNR1KMT2AMEN1L3MBTL1KDM4E
SCHEMBL2002975 0.87 HSP90AA1 (0.57) KMT2AMEN1L3MBTL1HSD17B10
SCHEMBL2008943 0.86 FAAH (0.52) CNR1KMT2AMEN1FAAHMAPK8
SCHEMBL2008436 0.86 FAAH (0.52) KMT2AMEN1FAAHMAPK8MAPK10
SCHEMBL2002840 0.86 MEN1 (0.47) CNR1KMT2AMEN1L3MBTL1MAPK1
SCHEMBL2012084 0.85 CNR1 (0.59) CNR1KMT2AMEN1L3MBTL1MAPT
SCHEMBL3066822 0.84 PRKAA2 (0.47) KMT2AMEN1FAAHL3MBTL1SMN1; SMN2
SCHEMBL3059814 0.84 CNR1 (0.55) CNR1KMT2AMEN1FAAHMAPT
SCHEMBL2013643 0.83 MEN1 (0.49) CNR1KMT2AMEN1L3MBTL1HSD17B10

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 3782/4885KMT2A 1844/4885MEN1 799/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KMT2A 1844/4885MEN1 799/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885KMT2A 1844/4885MEN1 799/4885

“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.