SCHEMBL968202

SCHEMBL968202

CC(C)(C)OC(=O)N1C(=O)CC[C@]1(Cc1ccccc1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
KLK7 P49862 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
TACR1 P25103 1/20 0.36
ACHE P22303 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
SCHEMBL29202479 1.00 STS (0.39) STSPDE4APDE4BPDE4CPDE4D
SCHEMBL1914273 0.82 DDB1 (0.33)
SCHEMBL483149 0.82 DDB1 (0.33)
SCHEMBL968201 0.80 GPR119 (0.39) STSOPRD1OPRK1KLK7GPR119
SCHEMBL28941207 0.78 STS (0.40) STSOPRD1OPRK1GPR119
SCHEMBL28923042 0.77 PDE4A (0.40) STSPDE4APDE4BPDE4CPDE4D
SCHEMBL28629670 0.77 PDE4A (0.40) STSPDE4APDE4BPDE4CPDE4D
SCHEMBL8399847 0.77 KLK7 (0.37) STSPDE4APDE4BPDE4CPDE4D
SCHEMBL387446 0.77
SCHEMBL194209 0.77

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879808-B2 potent activity against resistant pneumococci; for treating domestic fowl MEIJI SEIKA KAISHA, LTD. (JP) 2011-02-01 US disclosed
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US disclosed
US-7867980-B2 Lincosamide derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-11 US disclosed