SCHEMBL7269457

SCHEMBL7269457

O=C(O)C(CC(=O)N1CCOCC1)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
CPA1 P15085 4/20 0.55
CPA3 P15088 2/20 0.55
CPB1 P15086 1/20 0.55
CPB2 Q96IY4 1/20 0.55
ALDH1A1 P00352 2/20 0.53
MMP8 P22894 1/20 0.53
HPGD P15428 1/20 0.53
CYP1A2 P05177 1/20 0.53
MAPT P10636 1/20 0.52
FOLH1 Q04609 1/20 0.51
CTSL P07711 1/20 0.51
NPSR1 Q6W5P4 1/20 0.49
MME P08473 1/20 0.49
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
USP2 O75604 1/20 0.48

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
SCHEMBL7291450 1.00 FKBP1A (0.58) FKBP1AMEN1KMT2ACPA1CPA3
SCHEMBL7269464 1.00 FKBP1A (0.58) FKBP1AMEN1KMT2ACPA1CPA3
SCHEMBL7539281 0.89 FKBP1A (0.56) FKBP1AMEN1KMT2AALDH1A1MMP8
SCHEMBL7539288 0.89 FKBP1A (0.56) FKBP1AMEN1KMT2AALDH1A1MMP8
SCHEMBL9554813 0.86 FKBP1A (0.63) FKBP1AMEN1KMT2ACPA3MMP8
SCHEMBL9554804 0.86 FKBP1A (0.63) FKBP1AMEN1KMT2ACPA3MMP8
SCHEMBL5421601 0.84 FKBP1A (0.51) FKBP1AMEN1KMT2AALDH1A1MMP8
SCHEMBL5955863 0.84 FKBP1A (0.51) FKBP1AMEN1KMT2AALDH1A1MMP8
SCHEMBL7269161 0.84 FKBP1A (0.62) FKBP1AKMT2AALDH1A1HPGDMAPT
SCHEMBL5955811 0.84 FKBP1A (0.51) FKBP1AMEN1KMT2AALDH1A1MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0383635-B1 Peptides having renin inhibitory activity their preparation and use SANKYO CO (JP) 1995-07-12 EP disclosed
EP-0466405-B1 2,2'-Bis(dicyclopenthylphosphino)-1-1'-binaphthyl and metal complexes thereof TAKASAGO PERFUMERY CO LTD (JP) 1995-02-22 EP disclosed
US-5389616-A Renin inhibitor, hypotensive agent HOFFMAN-LAROCHE INC. (US) 1995-02-14 US disclosed
US-5378689-A Hypotensive agents; administrable by mouth SANKYO COMPANY, LIMITED (JP) 1995-01-03 US disclosed
US-5364844-A Hypotensive agents SANKYO COMPANY, LIMITED (JP) 1994-11-15 US disclosed
EP-0229667-B1 Peptidylaminodiols ABBOTT LAB (US) 1994-07-13 EP disclosed
US-5312939-A 2,2'-bis (dicyclopentylphosphino)-1,1'-binaphthyl and transition metal complex using the same as ligand TAKASAGO INTERNATIONAL CORPORATION (JP) 1994-05-17 US disclosed
EP-0587767-A1 HYDROXYAZIDO DERIVATIVES AND RELATED COMPOUNDS AS RENIN INHIBITORS SRI INTERNATIONAL (US) 1994-03-23 EP disclosed
US-5268361-A Containing amide groups SRI INTERNATIONAL (US) 1993-12-07 US disclosed
US-5256645-A Renin inhibitors; hypotensive agents HOFFMANN-LA ROCHE INC. (US) 1993-10-26 US disclosed
US-4845079-A HYPOTENSIVE, RENIN INHIBITION ABBOTT LABORATORIES 1989-07-04 US disclosed
US-4839357-A TREATMENT OF HYPERTENSION, CONGESTIVE HEART FAILURE MERCK & CO., INC. (US) 1989-06-13 US disclosed
US-4837204-A RENIN INHIBITORS; HYPOTENSIVE AGENTS ABBOTT LABORATORIES (US) 1989-06-06 US disclosed
US-4826815-A HYPOTENSIVE ABBOTT LABORATORIES (US) 1989-05-02 US disclosed
EP-0310918-A2 Peptide-like amino-acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-04-12 EP disclosed
EP-0295294-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-12-21 EP disclosed
EP-0278158-A2 Renin inhibitors containing phenylalanyl-histidine replacements MERCK & CO. INC. (US) 1988-08-17 EP disclosed
WO-1988005050-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-07-14 WO 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