SCHEMBL8625658

SCHEMBL8625658

C/C=C(\C(=O)O)c1nc(NC(=O)OC(C)(C)C)sc1Cl

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LCK P06239 14/20 0.44
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
PI4KB Q9UBF8 1/20 0.37

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
SCHEMBL10428936 0.90 LCK (0.44) LCKCA1CA2PI4KB
SCHEMBL8819572 0.88 LCK (0.41) LCKCA1CA2PI4KB
SCHEMBL8819561 0.88 LCK (0.41) LCKCA1CA2PI4KB
SCHEMBL13403561 0.86 LCK (0.46) LCKCA1CA2PI4KB
SCHEMBL13437781 0.83 LCK (0.45) LCKCA1CA2PI4KB
SCHEMBL23214462 0.82 LCK (0.46) LCKCA1CA2PI4KB
SCHEMBL22667919 0.80 LCK (0.45) LCKCA1CA2PI4KB
SCHEMBL13437782 0.80 LCK (0.39) LCKCA1CA2PI4KB
SCHEMBL10428702 0.79 SMN1; SMN2 (0.38) LCK
SCHEMBL13437814 0.77 LCK (0.39) LCKCA1CA2PI4KB

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
EP-0675116-B1 Preparation of protected aminothiazolylacetic acid derivatives EISAI KAGAKU KK (JP) 1998-06-17 EP disclosed
US-4943568-A Cephalosporins BAYER AKTIENGESELLSCHAFT (DE) 1990-07-24 US disclosed
EP-0223184-A2 Cephalosporins, process for their preparation and their use as medicaments BAYER AG (DE) 1987-05-27 EP disclosed