SCHEMBL3619675

SCHEMBL3619675

O=C1c2sccc2CS(=O)(=O)c2cccc(NC(=O)C(O)C(F)(F)F)c21

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
MAPT P10636 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
SCHEMBL5766426 0.85 KDM4E (0.36) KDM4EMAPT
SCHEMBL5768181 0.85 KDM4E (0.33) KDM4EMAPT
SCHEMBL5764009 0.84 KDM4E (0.34) KDM4EMAPT
SCHEMBL5766878 0.82 CCNE2 (0.42) KDM4EMAPT
SCHEMBL5766255 0.82 TAS1R3 (0.34) KDM4E
SCHEMBL5765490 0.81 KDM4E (0.37) KDM4EMAPT
SCHEMBL3951080 0.81 PDK1 (0.45)
SCHEMBL4688651 0.81 PDK1 (0.45)
SCHEMBL5763655 0.81 PDK1 (0.45)
SCHEMBL5764200 0.81 ALDH1A1 (0.40) KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267796-A1 THERAPEUTIC AGENT FOR IRRITABLE BOWEL SYNDROME KYOWA HAKKO KOGYO CO., LTD. (JP) 2010-10-21 US disclosed
EP-2077122-A1 THERAPEUTIC AGENTS FOR IRRITABLE BOWEL SYNDROME Kyowa Hakko Kirin Co., Ltd. (JP) 2009-07-08 EP 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-20100267796-A1 THERAPEUTIC AGENT FOR IRRITABLE BOWEL SYNDROME SLC10A2, ADORA3, HRH2 KDM4E 3186/4885MAPT 4871/4885

“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.