SCHEMBL2553802

SCHEMBL2553802

COC(=O)C(N)CSCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.52
KIF11 P52732 1/20 0.51
IDO1 P14902 1/20 0.48
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
ACE P12821 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
LTA4H P09960 1/20 0.44
MAPT P10636 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL4141148 1.00 METAP2 (0.52) METAP2KIF11IDO1PPARGPPARA
SCHEMBL1839764 1.00 METAP2 (0.52) METAP2KIF11IDO1PPARGPPARA
Hydrochloric Acid SCHEMBL3119114 0.98 METAP2 (0.51) METAP2KIF11IDO1PPARGPPARA
Hydrochloric Acid SCHEMBL4141147 0.98 METAP2 (0.51) METAP2KIF11IDO1PPARGPPARA
Hydrochloric Acid SCHEMBL2971264 0.98 METAP2 (0.51) METAP2KIF11IDO1PPARGPPARA
Hydrochloric Acid SCHEMBL2123378 0.97 METAP2 (0.50) METAP2KIF11IDO1PPARGPPARA
Cyanide SCHEMBL28390031 0.96 METAP2 (0.49) METAP2KIF11IDO1PPARGPPARA
SCHEMBL2238552 0.86 METAP2 (0.60) METAP2IDO1PPARGPPARAACE
SCHEMBL31512919 0.86 KIF11 (0.50) METAP2KIF11IDO1L3MBTL1LTA4H
SCHEMBL7303633 0.86 KIF11 (0.50) METAP2KIF11L3MBTL1LTA4HMAPT

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
EP-2556051-A1 PROCESS FOR PRODUCING SULFUR-CONTAINING AMINO ACIDS Sumitomo Chemical Company, Limited (JP) 2013-02-13 EP disclosed
US-20130023696-A1 PROCESS FOR PRODUCING SULFUR-CONTAINING AMINO ACIDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-01-24 US disclosed
CN-102834376-A Process for producing sulfur-containing amino acids SUMITOMO CHEMICAL CORP 2012-12-19 CN disclosed
WO-2011126129-A1 PROCESS FOR PRODUCING SULFUR-CONTAINING AMINO ACIDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-13 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-20130023696-A1 PROCESS FOR PRODUCING SULFUR-CONTAINING AMINO ACIDS CBS, CTH, BCAT2 METAP2 23/4885KIF11 4625/4885IDO1 182/4885

“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.