SCHEMBL1664180

SCHEMBL1664180

CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@H](O)C2)C(=O)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.51
CHRM1 P11229 1/20 0.51
CHRM3 P20309 1/20 0.51
PREP P48147 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
THRB P10828 1/20 0.41
DDB1 Q16531 2/20 0.41
CRBN Q96SW2 2/20 0.41
TP53 P04637 1/20 0.39
NR1H2 P55055 1/20 0.38
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 2/20 0.38
GPR119 Q8TDV5 1/20 0.37
ESR2 Q92731 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE7A Q13946 1/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL2322107 1.00 CHRM2 (0.51) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583351 0.93 CHRM2 (0.49) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583349 0.93 CHRM2 (0.49) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1663196 0.93 CHRM2 (0.49) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL5619854 0.90 CHRM2 (0.46) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583786 0.86 CHRM2 (0.47) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583785 0.86 CHRM2 (0.47) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583626 0.85 NR1H2 (0.50) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL1583858 0.85 TP53 (0.44) CHRM2CHRM1CHRM3PREPMAPT
SCHEMBL3069589 0.84 EPHX1 (0.47) CHRM2CHRM1CHRM3PREPMAPT

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-2011050284-A1 PYRAZOLYLPYRIDINE ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2011-04-28 WO disclosed