SCHEMBL6016853

SCHEMBL6016853

CC(C)(C)OC(=O)N1CC2CCCCC2C1(C)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
NR1H2 P55055 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HPGD P15428 1/20 0.35
PREP P48147 3/20 0.35
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NR1H3 Q13133 1/20 0.32
GPR119 Q8TDV5 3/20 0.32
HSD11B1 P28845 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RECQL P46063 1/20 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
SCHEMBL6016852 1.00 EPHX1 (0.37) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL6488112 0.83 EPHX1 (0.35) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL6016799 0.82 MEN1 (0.39) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL6016798 0.82 MEN1 (0.39) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL7564909 0.75 EPHX1 (0.36) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL501214 0.74 NR1H2 (0.35) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL20031478 0.71 NR1H2 (0.60) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL29180653 0.71 NR1H2 (0.60) EPHX1NR1H2CHRM2CHRM1CHRM3
SCHEMBL29057889 0.70 HSD17B10 (0.41) EPHX1CHRM2CHRM1CHRM3HPGD
SCHEMBL28959377 0.70 NR1H2 (0.38) EPHX1NR1H2CHRM2CHRM1CHRM3

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-1615886-A1 [C]-FUSED BICYCLIC PROLINE DERIVATIVES AND THEIR USE FOR TREATING ARTHRITIC CONDITIONS Warner-Lambert Company LLC (US) 2006-01-18 EP disclosed
WO-2004092134-A1 [C]-FUSED BICYCLIC PROLINE DERIVATIVES AND THEIR USE FOR TREATING ARTHRITIC CONDITIONS WARNER-LAMBERT COMPANY LLC (US) 2004-10-28 WO disclosed