SCHEMBL8560414

SCHEMBL8560414

CC(C)C(=O)OCOC(=O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL8560408 0.87 TSHR (0.34) TSHR
SCHEMBL681184 0.84 ELANE (0.34) TSHR
SCHEMBL6002437 0.82 OR51E2 (0.30)
SCHEMBL217247 0.80 TSHR (0.33) TSHR
SCHEMBL19680509 0.77 TSHR (0.57) TSHR
SCHEMBL217246 0.77 ALDH1A1 (0.41) TSHR
SCHEMBL7606317 0.75 ALDH1A1 (0.43) TSHR
SCHEMBL9313073 0.75 ALDH1A1 (0.43) TSHR
SCHEMBL7877041 0.74 ALDH1A1 (0.33)
SCHEMBL11631362 0.74 ELANE (0.32) TSHR

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-0559533-B1 Process for preparing beta-lactam derivative and synthetic intermediate thereof TANABE SEIYAKU CO (JP) 1998-07-22 EP disclosed
US-5589592-A Process for preparing β-lactam derivative and synthetic intermediate TANABE SEIYAKU CO., LTD. (JP) 1996-12-31 US disclosed
US-5414081-A Treating a 1-aza-3-thiabicycloalkane with base and phosphine or phosphite desulfurizing agent, and reacting the product with an active esterifying agent TANABE SEIYAKU CO., LTD. (JP) 1995-05-09 US disclosed
EP-0559533-A1 Process for preparing beta-lactam derivative and synthetic intermediate thereof TANABE SEIYAKU CO., LTD. (JP) 1993-09-08 EP disclosed