SCHEMBL9718080

SCHEMBL9718080

CC(C)(C)OC(=O)NC(CNC(=O)OCc1ccccc1)C(=O)OCC[Si](C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.57
MAPT P10636 1/20 0.53
CTSS P25774 6/20 0.49
PPARA Q07869 3/20 0.49
KLK7 P49862 4/20 0.48
KLK5 Q9Y337 4/20 0.48
CTSK P43235 5/20 0.47
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
PPARG P37231 2/20 0.45
ITGB3 P05106 1/20 0.44
ITGA2B P08514 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
SCHEMBL29687334 0.96 SYK (0.54) SYKMAPTCTSSPPARAKLK7
SCHEMBL13723801 0.96 SYK (0.63) SYKMAPTCTSSPPARACTSK
SCHEMBL21906231 0.89 SYK (0.51) SYKMAPTCTSSPPARAKLK7
SCHEMBL21906212 0.89 SYK (0.51) SYKMAPTCTSSPPARAKLK7
SCHEMBL20669513 0.88 PPARA (0.64) SYKMAPTCTSSPPARAKLK7
SCHEMBL17773023 0.87 MAPT (0.66) MAPTKLK7KLK5ITGB3ITGA2B
SCHEMBL18340847 0.87 SYK (0.64) SYKMAPTCTSSPPARAKLK7
SCHEMBL6231600 0.87 SYK (0.64) SYKMAPTCTSSPPARAKLK7
SCHEMBL14842312 0.87 SYK (0.64) SYKMAPTCTSSPPARAKLK7
SCHEMBL20297671 0.87 SYK (0.64) SYKMAPTCTSSPPARAKLK7

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-5153327-A 7-Oxabicycloheptyl substituted heterocyclic amide or ester prostaglandin analogs useful in the treatment of thrombotic and vasospastic disease E. R. SQUIBB & SONS, INC. (US) 1992-10-06 US disclosed
US-5100889-A Thromboxane A2 receptor antagonists, thromboxane synthetase inhibitor E. R. SQUIBB & SONS, INC. (US) 1992-03-31 US disclosed
EP-0374952-A2 7-Oxabicycloheptyl substituted heterocyclic amide prostaglandin analogs useful in the treatment of thrombotic and vasospastic disease E.R. SQUIBB & SONS, INC. (US) 1990-06-27 EP disclosed