SCHEMBL9964377

SCHEMBL9964377

Cc1cc(OCC2(C)COC2)cc(C)c1-c1cccc(COc2ccc(-c3cc(O)n[s+]3[O-])cc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.43
CD274 Q9NZQ7 8/20 0.33
PTGS2 P35354 1/20 0.32
CYP2C8 P10632 1/20 0.31

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
SCHEMBL9964372 0.85 FFAR1 (0.59) FFAR1
SCHEMBL9964379 0.85 FFAR1 (0.41) FFAR1CD274
SCHEMBL9964374 0.83 FFAR1 (0.40) FFAR1CD274
SCHEMBL9964354 0.82 FFAR1 (0.42) FFAR1CD274
SCHEMBL9964391 0.81 FFAR1 (0.38) FFAR1CD274
SCHEMBL9934654 0.81 FFAR1 (0.38) FFAR1CD274
SCHEMBL9964383 0.81 CD274 (0.41) FFAR1CD274
SCHEMBL9964388 0.81 FFAR1 (0.38) FFAR1CD274
SCHEMBL9964361 0.80 FFAR1 (0.46) FFAR1CD274
SCHEMBL9964359 0.78 FFAR1 (0.44) FFAR1CD274

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 39/4885CD274 4376/4885PTGS2 3655/4885

“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.