SCHEMBL3049586

SCHEMBL3049586

CCCCCCCCCCS(=O)(=O)N1CCCN(c2nc(Cc3ccc(Oc4ccc(C)cc4)cc3)ns2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.44
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPK1 P28482 2/20 0.32
LMNA P02545 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PLA2G2A P14555 1/20 0.30
HTR6 P50406 1/20 0.30
SMO Q99835 1/20 0.30
TSHR P16473 1/20 0.30
RECQL P46063 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CNR2 P34972 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
SCHEMBL3054660 1.00 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3068666 1.00 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3068431 1.00 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3051317 0.96 CNR1 (0.45) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3064073 0.93 CNR1 (0.46) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3055810 0.91 CNR1 (0.49) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3055027 0.91 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL2001119 0.91 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3056425 0.90 CNR1 (0.44) CNR1MEN1KMT2AMAPK1LMNA
SCHEMBL3056411 0.89 CNR1 (0.46) CNR1MEN1KMT2AMAPK1LMNA

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

“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.