SCHEMBL9964356

SCHEMBL9964356

Cc1cc(OC2CCS(=O)(=O)CC2)cc(C)c1-c1cccc(COc2ccc(-c3cc(O)n[s+]3[O-])cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.58
DRD4 P21917 1/20 0.58
ADRA1D P25100 1/20 0.58
DRD3 P35462 1/20 0.58

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
SCHEMBL9964359 0.86 FFAR1 (0.44) FFAR1DRD4ADRA1DDRD3
SCHEMBL13505525 0.83 FFAR1 (0.60) FFAR1DRD4ADRA1DDRD3
SCHEMBL9934172 0.82 FFAR1 (0.53) FFAR1
SCHEMBL1688184 0.80 FFAR1 (0.52) FFAR1
Bicarbonate SCHEMBL16223958 0.79 FFAR1 (0.68) FFAR1DRD4ADRA1DDRD3
SCHEMBL1688194 0.79 FFAR1 (0.48) FFAR1
SCHEMBL5115185 0.78 FFAR1 (0.80) FFAR1DRD4ADRA1DDRD3
SCHEMBL9934590 0.78 FFAR1 (0.48) FFAR1
SCHEMBL1688182 0.78 FFAR1 (0.60) FFAR1
SCHEMBL1688190 0.78 FFAR1 (0.65) FFAR1

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-8476287-B2 3-hydroxy-5-arylisothiazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-07-02 US disclosed
US-8476287-B2 3-hydroxy-5-arylisothiazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2013-07-02 US disclosed
US-20120157459-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-06-21 US disclosed
US-20120157459-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2012-06-21 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 (1 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-20120157459-A1 NOVEL 3-HYDROXY-5-ARYLISOTHIAZOLE DERIVATIVE GPR119, GPR27, NR0B1 FFAR1 39/4885DRD4 975/4885ADRA1D 73/4885

“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.