SCHEMBL3716092

SCHEMBL3716092

CN(C)C(=O)CN1CCC(C)(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PER2 O15055 2/20 0.36
CRY2 Q49AN0 2/20 0.36
ALDH1A1 P00352 1/20 0.35
OPRM1 P35372 4/20 0.33
OPRL1 P41146 4/20 0.33
DDR1 Q08345 1/20 0.32
AOC2 O75106 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
PARG Q86W56 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
BDKRB2 P30411 1/20 0.31
POLQ O75417 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
SCHEMBL15438497 0.80 KMT2A (0.42) PER2CRY2ALDH1A1AOC2BDKRB2
SCHEMBL3715212 0.79 TSHR (0.46) PER2CRY2OPRM1OPRL1AOC2
SCHEMBL3547090 0.77 CACNA1H (0.36) ALDH1A1OPRM1OPRL1DDR1NPSR1
SCHEMBL16703117 0.71 PER2 (0.39) PER2CRY2OPRM1OPRL1AOC2
SCHEMBL21389132 0.71 PER2 (0.40) PER2CRY2OPRM1OPRL1AOC2
SCHEMBL22833746 0.69 TSHR (0.51) PER2CRY2ALDH1A1OPRM1OPRL1
SCHEMBL2036528 0.68 TSHR (0.59) ALDH1A1
Ammonia Solution, Strong SCHEMBL8031383 0.67 PER2 (0.37) PER2CRY2OPRM1OPRL1AOC2
SCHEMBL17176024 0.66 ALDH1A1 (0.45) ALDH1A1OPRM1OPRL1
SCHEMBL13432030 0.64 PER2 (0.35) PER2CRY2OPRM1OPRL1AOC2

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
WO-2010132693-A2 OLIGOMER-CONTAINING PYRROLIDINE COMPOUNDS NEKTAR THERAPEUTICS (US) 2010-11-18 WO disclosed