SCHEMBL7274112

SCHEMBL7274112

CC(C=O)N(C(=O)OC(C)(C)C)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.38
ADH1C P00326 3/20 0.38
ADH1B P00325 1/20 0.38
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
EPHX1 P07099 2/20 0.32
HPGD P15428 1/20 0.31
BTK Q06187 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.30

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
SCHEMBL3285529 1.00 ADH1A (0.38) ADH1AADH1CADH1BGAATSHR
SCHEMBL3285531 0.98 ADH1C (0.35) ADH1AADH1CADH1BGAATSHR
SCHEMBL3671338 0.97 ADH1B (0.33) ADH1AADH1CADH1BBTK
SCHEMBL3671340 0.97 ADH1B (0.33) ADH1AADH1CADH1BBTK
SCHEMBL14666763 0.84 ADH1B (0.38) ADH1AADH1CADH1BGAATSHR
SCHEMBL647264 0.81 TSHR (0.37) ADH1AADH1CADH1BGAATSHR
SCHEMBL9744375 0.81 TSHR (0.37) ADH1AADH1CADH1BGAATSHR
SCHEMBL9744380 0.81 TSHR (0.37) ADH1AADH1CADH1BGAATSHR
SCHEMBL2712968 0.81 TSHR (0.37) ADH1AADH1CADH1BGAATSHR
SCHEMBL4328796 0.81 TSHR (0.37) ADH1AADH1CADH1BGAATSHR

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5703129-A 5-amino-6-cyclohexyl-4-hydroxy-hexanamide derivatives as inhibitors of β-amyloid protein production BRISTOL-MYERS SQUIBB COMPANY (US) 1997-12-30 US disclosed
EP-0778266-A1 5-Amino-6-cyclohexyl-4-hydroxy-hexanamide derivatives as inhibitors of beta-amyloid protein production BRISTOL-MYERS SQUIBB COMPANY (US) 1997-06-11 EP disclosed
EP-0401676-B1 Enzyme inhibitors BIO MEGA BOEHRINGER INGELHEIM (CA) 1995-01-11 EP disclosed
US-5346887-A Mixture of tripeptide renin inhibitor and steroid antiinflammatory agent ABBOTT LABORATORIES (US) 1994-09-13 US disclosed
EP-0229667-B1 Peptidylaminodiols ABBOTT LAB (US) 1994-07-13 EP disclosed
EP-0255082-B1 Renin-inhibiting di- and tripeptides, methods for their production, drugs containing them, and their use HOECHST AG (DE) 1993-12-01 EP disclosed
US-5214129-A Amidation of a protected amino acid by an di-O-protected dihydroxy-containing amine and coupling with a carboxylic acid; deprotecting; renin inhibitors; hypotensive agents ABBOTT LABORATORIES (US) 1993-05-25 US disclosed
US-5212157-A Tetrapeptides as inhibitors of HIV BIO-MEGA, INC. (CA) 1993-05-18 US disclosed
US-5091575-A Renin inhibitor ABBOTT LABORATORIES (US) 1992-02-25 US disclosed
US-5059589-A Glaucoma treatment ABBOTT LABORATORIES (US) 1991-10-22 US disclosed
WO-1988005050-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-07-14 WO disclosed
EP-0258289-A1 PEPTIDE ANALOGS ABBOTT LABORATORIES (US) 1988-03-09 EP disclosed
US-4725583-A ANTIHYPERTENSIVE ABBOTT LABORATORIES (US) 1988-02-16 US disclosed
EP-0255082-A2 Renin-inhibiting di- and tripeptides, methods for their production, drugs containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1988-02-03 EP disclosed
WO-1987004349-A1 PEPTIDE ANALOGS DELLARIA JOSEPH 1987-07-30 WO disclosed
EP-0230242-A2 Substituted derivatives of 4-amino-3-hydroxy-butyric acid, process for their production, medicines containing them, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-29 EP disclosed
EP-0230266-A2 Functionalized peptidyl aminodiols and -triols ABBOTT LABORATORIES (US) 1987-07-29 EP disclosed
EP-0229667-A2 Peptidylaminodiols ABBOTT LABORATORIES (US) 1987-07-22 EP disclosed
EP-0189203-A2 Peptidylaminodiols ABBOTT LABORATORIES (US) 1986-07-30 EP disclosed
EP-0184855-A2 Resin inhibiting compounds ABBOTT LABORATORIES (US) 1986-06-18 EP disclosed