SCHEMBL4184059

SCHEMBL4184059

CCSN(SCC)C(=O)SSC(=O)N(SCC)SCC

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL7282131 0.79 TSHR (0.33) TSHRMAPK1
SCHEMBL4631571 0.77 ALDH1A1 (0.35) TSHRMAPK1ALDH1A1
SCHEMBL5608381 0.74 FFAR3 (0.35) TSHRMAPK1ALDH1A1
SCHEMBL7122582 0.74 ALDH1A1 (0.35) TSHRMAPK1ALDH1A1
SCHEMBL4557462 0.72 TSHR (0.32) TSHRMAPK1ALDH1A1
SCHEMBL10822936 0.72 ALDH1A1 (0.43) TSHRMAPK1ALDH1A1
Hydrochloric Acid SCHEMBL10822937 0.72 FFAR3 (0.33) TSHRMAPK1ALDH1A1
SCHEMBL11301434 0.72 ALDH1A1 (0.32) TSHRMAPK1ALDH1A1
SCHEMBL3257895 0.70 FFAR3 (0.32) TSHRMAPK1ALDH1A1
Zinc Ion SCHEMBL15136365 0.70 FFAR3 (0.32) TSHRMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090209480-A1 CENTRAL ADMINISTRATION OF STABLE FORMULATIONS OF THERAPEUTIC AGENTS FOR CNS CONDITIONS THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2009-08-20 US disclosed
EP-0928340-A1 INVASION-INDUCING AGENTS AND INVASION-INHIBITORS FOR USE IN WOUND HEALING AND CANCER THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1999-07-14 EP disclosed
WO-1998022617-A1 INVASION-INDUCING AGENTS AND INVASION-INHIBITORS FOR USE IN WOUND HEALING AND CANCER THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1998-05-28 WO 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-20090209480-A1 CENTRAL ADMINISTRATION OF STABLE FORMULATIONS OF THERAPEUTIC AGENTS FOR CNS CONDITIONS INA, BDNF, PMP22 TSHR 3061/4885MAPK1 3744/4885ALDH1A1 2618/4885

“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.