SCHEMBL9784263

SCHEMBL9784263

CC(C)(C)OC(=O)C(C)(C)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.58
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL3141601 0.83 DGAT1 (0.79) DGAT1
SCHEMBL186201 0.79 DGAT1 (0.46) DGAT1MAOAMAOB
SCHEMBL28714854 0.77 DGAT1 (0.44) DGAT1MAOAMAOB
SCHEMBL29908023 0.77 DGAT1 (0.44) DGAT1MAOAMAOB
SCHEMBL8678863 0.77 DGAT1 (0.62) DGAT1
SCHEMBL30496820 0.77 DGAT1 (0.50) DGAT1
SCHEMBL410733 0.76
SCHEMBL4356324 0.76 DGAT1 (0.54) DGAT1
SCHEMBL998622 0.76 DGAT1 (0.61) DGAT1
SCHEMBL16787839 0.76 DGAT1 (0.61) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE33778-E 1,3-dithietane-2-carboxylic acid penicillin and cephalosporin derivatives YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-12-24 US disclosed
US-RE32491-E BACTERICIDES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1987-09-01 US disclosed
US-4414153-A 1,3-Dithietane-2-carboxylic acid penicillin and cephalosporin derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1983-11-08 US disclosed
US-4404373-A Process for the preparation of 7α-methoxy-7β-(1,3-diethietane-2-carboxamido)cephalosporanic acid derivatives YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1983-09-13 US disclosed
US-4263432-A ANTIBIOTICS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1981-04-21 US disclosed
US-4198339-A INTERMEDIATES FOR PENICILLINS AND CEPHALOSPORINS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1980-04-15 US disclosed