SCHEMBL28025927

SCHEMBL28025927

CC[C@@H]1CN(CC(=O)OC(=O)C(C)(C)C)CCN1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 1/20 0.37
MLNR O43193 1/20 0.33

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
SCHEMBL27947059 0.85 BIRC2 (0.52) BIRC2
SCHEMBL27991336 0.74 PARP1 (0.32)
SCHEMBL27972681 0.74 PARP1 (0.32)
SCHEMBL28317304 0.74 PARP1 (0.32)
Tert-Butyl Formate SCHEMBL28025928 0.73 BIRC2 (0.35) BIRC2MLNR
SCHEMBL27769699 0.73 BIRC2 (0.39) BIRC2MLNR
SCHEMBL28129541 0.73 BIRC2 (0.39) BIRC2MLNR
SCHEMBL16854473 0.72 BIRC2 (0.38) BIRC2
SCHEMBL16826797 0.72 BIRC2 (0.38) BIRC2
SCHEMBL14660329 0.72 BIRC2 (0.51) BIRC2MLNR

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
CN-103492376-B Bicyclic heterocycle compounds and their uses in therapy ASTEX THERAPEUTICS LTD 2015-07-22 CN disclosed