SCHEMBL3051603

SCHEMBL3051603

Cc1ccc(Oc2ccc(Cc3nsc(N4CCN(S(=O)(=O)c5ccccc5S(C)(=O)=O)CC4)n3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.42
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
GBA1 P04062 1/20 0.35
HSD11B1 P28845 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL3058037 0.87 MAPT (0.46) CNR1GAAPKMKMT2AALDH1A1
SCHEMBL3054823 0.87 KMT2A (0.43) CNR1PKMKMT2AALDH1A1HSD11B1
SCHEMBL3056348 0.86 CNR1 (0.44) CNR1PKMKMT2AALDH1A1GBA1
SCHEMBL3062212 0.84 PKM (0.44) CNR1PKMKMT2AALDH1A1GBA1
SCHEMBL2007328 0.83 MAPT (0.49) CNR1KMT2AALDH1A1GBA1HSD11B1
SCHEMBL3055780 0.83 TRPV4 (0.41) CNR1KMT2A
SCHEMBL3059277 0.82 CFTR (0.42) CNR1GAAPKMRAB9AKMT2A
SCHEMBL3063330 0.82 L3MBTL1 (0.44) CNR1GAAKMT2ATDP1ALDH1A1
SCHEMBL3063744 0.81 TSHR (0.45) CNR1GAAPKMTDP1ALDH1A1
SCHEMBL3055810 0.81 CNR1 (0.49) CNR1PKMKMT2ATDP1ALDH1A1

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 3782/4885GAA 203/4885PKM 1944/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885GAA 203/4885PKM 1944/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885GAA 203/4885PKM 1944/4885

“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.