SCHEMBL2549433

SCHEMBL2549433

CC(C)(C)N(C(=O)O)[C@H](CCC(N)=S)[C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM8 O00222 1/20 0.32
GRM4 Q14833 1/20 0.32
SLC6A9 P48067 2/20 0.31
UTS2R Q9UKP6 1/20 0.30

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
SCHEMBL2544118 0.92 GRM8 (0.33) GRM8GRM4SLC6A9UTS2R
SCHEMBL1596367 0.85 AKR1C3 (0.33) GRM8GRM4SLC6A9
SCHEMBL1742907 0.80 PDE2A (0.33) GRM8GRM4UTS2R
SCHEMBL2547956 0.80 PDE2A (0.33) GRM8GRM4UTS2R
SCHEMBL2551183 0.80 FFAR1 (0.33)
SCHEMBL2541349 0.78 TEAD1 (0.31)
SCHEMBL2548062 0.77 CES2 (0.32) SLC6A9
SCHEMBL12241695 0.76 PPARG (0.37) UTS2R
SCHEMBL1742760 0.73 TEAD1 (0.35) SLC6A9
SCHEMBL1594372 0.73 FFAR1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 GRM8 3910/4885GRM4 2696/4885SLC6A9 4142/4885

“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.