SCHEMBL8345871

SCHEMBL8345871

CCOP(=O)(O)CC(=O)CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.37
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30
PGGT1B P53609 1/20 0.30
BTN3A1 O00481 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
SCHEMBL9089264 0.76 PPARD (0.46) PPARD
SCHEMBL8345865 0.76 BTN3A1 (0.32) BTN3A1
SCHEMBL1876097 0.75 BACE1 (0.31)
SCHEMBL1549162 0.74 PPARD (0.50) PPARDFNTAFNTBPGGT1B
SCHEMBL9360474 0.74 TDP1 (0.38)
SCHEMBL3928093 0.70 PPARD (0.41) PPARDFNTAFNTBPGGT1B
SCHEMBL2142592 0.70
SCHEMBL9468147 0.69 TDP1 (0.33)
SCHEMBL28790081 0.69 MAPT (0.31)
SCHEMBL21379404 0.69 MAPT (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939410-A AN ANTIBIOTIC COMPRISING A HYDROLYSABLE ESTERS IN VIVO HOFFMANN-LA ROCHE INC. (US) 1999-08-17 US disclosed
EP-0831093-A1 1-Carba-(dethia)-Cephalosporin Derivatives F. HOFFMANN-LA ROCHE AG (CH) 1998-03-25 EP disclosed