SCHEMBL8363898

SCHEMBL8363898

CN[C@H]1CN(CC(C)O)C1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ RAB9A P51151 1/20 0.32
▸ CSNK2A1 P68400 3/20 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
SCHEMBL14170330 0.84 PIK3CD (0.34) PIK3CD
SCHEMBL14170888 0.84 PER2 (0.30) —
SCHEMBL14170266 0.79 MMP1 (0.39) PIK3CD
SCHEMBL14170234 0.77 PIK3CD (0.43) PIK3CD
SCHEMBL14170667 0.77 PIK3CD (0.33) PIK3CD
SCHEMBL14170738 0.77 PIK3CD (0.33) PIK3CD
SCHEMBL14170426 0.76 AR (0.33) PIK3CD
SCHEMBL14170178 0.76 PIK3CD (0.33) PIK3CD
SCHEMBL14170824 0.76 CASP1 (0.34) PIK3CD
SCHEMBL16838542 0.73 ALDH1A1 (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534495-B1 Anticoagulants that prevent thrombin-related diseases. AKZO NEBEL (NL) 2003-03-18 — — US disclosed
Send feedback