SCHEMBL9024908

SCHEMBL9024908

CC(=O)c1n[nH]c(C)c1CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.31
DUT P33316 2/20 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
SCHEMBL9025309 0.89 HCAR2 (0.41) HCAR2
SCHEMBL9027062 0.77 HCAR2 (0.33) HCAR2
SCHEMBL9026160 0.75 HCAR2 (0.37) HCAR2
SCHEMBL8536313 0.70 HCAR2 (0.43) HCAR2
SCHEMBL9037584 0.70 HCAR2 (0.36) HCAR2
SCHEMBL25097637 0.69
SCHEMBL9026702 0.67 NPC1 (0.44)
SCHEMBL19586624 0.66 MAPK1 (0.40)
SCHEMBL31358621 0.64 DUT (0.31) DUT
SCHEMBL1085871 0.63 MAPT (0.33) DUT

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
EP-0725783-A1 2-(PYRAZOL-3-YL)CARBAPENEM DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1996-08-14 EP disclosed
WO-1995011905-A1 2-(PYRAZOL-3-YL)CARBAPENEM DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1995-05-04 WO disclosed