SCHEMBL7646464

SCHEMBL7646464

CC(C)(C)OC(=O)N1C2CCC1C(C(=O)O)C(=O)C2C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
PREP P48147 4/20 0.38
CYP1A2 P05177 1/20 0.38
HIF1A Q16665 1/20 0.38
ABCB1 P08183 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
DDB1 Q16531 2/20 0.36
CRBN Q96SW2 2/20 0.36
HSD11B1 P28845 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL1010269 0.84 CYP1A2 (0.54) CHRM2CHRM1CHRM3PREPCYP1A2
SCHEMBL7247150 0.83 CHRM2 (0.48) CHRM2CHRM1CHRM3PREPABCB1
SCHEMBL22000397 0.83 CHRM2 (0.49) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL13480843 0.81 CHRM2 (0.50) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL19570649 0.78 CHRM2 (0.55) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL3091698 0.78 CHRM2 (0.55) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL23264873 0.77 CHRM2 (0.53) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL3866475 0.76 CYP1A2 (0.49) CHRM2CHRM1CHRM3PREPCYP1A2
SCHEMBL13480844 0.75 CHRM2 (0.45) CHRM2CHRM1CHRM3PREPGPR119
SCHEMBL797568 0.75 CHRM2 (0.46) CHRM2CHRM1CHRM3PREPCYP1A2

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-6486323-B1 Process for producing optically active tropinonemonocarboxylic acid derivative NIHON MEDI-PHYSICS CO., LTD. (JP) 2002-11-26 US disclosed