SCHEMBL3055583

SCHEMBL3055583

Cc1ccc(Cc2nsc(N3CCN(S(=O)(=O)c4ccccc4S(C)(=O)=O)C(C)C3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.41
NAAA Q02083 4/20 0.34
TSHR P16473 2/20 0.34
USP2 O75604 1/20 0.34
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 1/20 0.32
HTR6 P50406 1/20 0.32
GPR119 Q8TDV5 2/20 0.32
HSD11B1 P28845 3/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL12569125 0.89 CNR1 (0.45) CNR1TSHRHTR6ALDH1A1
SCHEMBL3052047 0.87 ALDH1A1 (0.40) CNR1TSHRGPR119HSD11B1ALDH1A1
SCHEMBL2007089 0.86 ALDH1A1 (0.42) CNR1TSHRHSD11B1ALDH1A1GAA
SCHEMBL3045693 0.85 ALDH1A1 (0.46) CNR1NAAATSHRUSP2ALDH1A1
SCHEMBL8239514 0.84 USP2 (0.40) CNR1TSHRUSP2HSD11B1
SCHEMBL3054414 0.84 ALDH1A1 (0.40) CNR1TSHRHSD11B1ALDH1A1GAA
SCHEMBL3065303 0.84 LMNA (0.44) CNR1TSHRHTR6HSD11B1ALDH1A1
SCHEMBL2003926 0.83 CNR1 (0.40) CNR1TSHRUSP2HTR6ALDH1A1
SCHEMBL2010784 0.83 ACHE (0.41) CNR1TSHRHSD11B1ALDH1A1
SCHEMBL2009133 0.83 HSD11B1 (0.49) HSD11B1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8551999-B2 Heterocyclic compound and pharmaceutical composition thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-08 US disclosed
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
EP-2207773-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMA CO LTD (JP) 2012-07-11 EP disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 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 (4 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-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF COL1A1, COL2A1, COL14A1 CNR1 65/4885NAAA 3835/4885TSHR 793/4885
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885NAAA 3714/4885TSHR 3338/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885NAAA 3714/4885TSHR 3338/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 CNR1 3782/4885NAAA 3714/4885TSHR 3338/4885

“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.