SCHEMBL7993429

SCHEMBL7993429

CCOC(=O)Cn1cc2c(n1)CC1CCC2N1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ENPP2 Q13822 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.35
HSD11B1 P28845 1/20 0.35
ALDH1A1 P00352 2/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PREP P48147 2/20 0.33
GPR119 Q8TDV5 1/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
GLA P06280 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL7985907 0.92 L3MBTL1 (0.38) CHRM1L3MBTL1GAAKMT2AALDH1A1
SCHEMBL7985658 0.87 CHRM2 (0.39) CHRM2CHRM1CHRM3GAAHSD11B1
SCHEMBL7989252 0.77 RAB9A (0.35) GAAKMT2AALDH1A1KDM4ELMNA
SCHEMBL7989746 0.77 SMN1; SMN2 (0.39) CHRM2CHRM1CHRM3GAAKMT2A
SCHEMBL31699296 0.72 CHRM2 (0.38) CHRM2CHRM1CHRM3GAAKMT2A
SCHEMBL7989581 0.72 L3MBTL1 (0.36) CHRM2CHRM1CHRM3L3MBTL1KMT2A
SCHEMBL31692322 0.72 CHRM2 (0.43) CHRM2CHRM1CHRM3HSD11B1PREP
SCHEMBL31692475 0.72 CHRM2 (0.43) CHRM2CHRM1CHRM3HSD11B1PREP
SCHEMBL30390991 0.71 CHRM2 (0.41) CHRM2CHRM1CHRM3HSD11B1PREP
SCHEMBL30405603 0.71 CHRM1 (0.51) CHRM2CHRM1CHRM3L3MBTL1HSD11B1

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
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed