SCHEMBL7322988

SCHEMBL7322988

CCOC(=O)[C@@H](N)CCSCC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 8/20 0.54
METAP1 P53582 5/20 0.54
BHMT Q93088 5/20 0.41
BHMT2 Q9H2M3 1/20 0.41
NOD1 Q9Y239 1/20 0.39
NOS2 P35228 2/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
ALOX15 P16050 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL7322982 1.00 METAP2 (0.54) METAP2METAP1BHMTBHMT2NOD1
SCHEMBL10681733 1.00 METAP2 (0.54) METAP2METAP1BHMTBHMT2NOD1
SCHEMBL24335665 0.85 METAP2 (0.47) METAP2METAP1BHMTBHMT2NOS2
SCHEMBL17901898 0.85 METAP2 (0.43) METAP2METAP1BHMTBHMT2NOS2
SCHEMBL1839255 0.84 NOD1 (0.40) METAP2METAP1BHMTBHMT2NOD1
SCHEMBL1839254 0.84 NOD1 (0.40) METAP2METAP1BHMTBHMT2NOD1
Hydrochloric Acid SCHEMBL6776434 0.83 METAP2 (0.46) METAP2METAP1BHMTBHMT2NOS2
Hydrochloric Acid SCHEMBL6776435 0.83 METAP2 (0.46) METAP2METAP1BHMTBHMT2NOS2
SCHEMBL113611 0.82 METAP2 (0.53) METAP2METAP1NOD1ALOX15CYP2D6
SCHEMBL5443843 0.82 METAP2 (0.53) METAP2METAP1NOD1ALOX15CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5262436-A Administering; enzyme inhibitor SCHERING CORPORATION (US) 1993-11-16 US disclosed
EP-0566157-A1 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1993-10-20 EP disclosed
US-5100786-A Gene capable of enhancing S-adenosyl-L-methionine accumulation and process for producing S-adenosyl-L-methionine using the same KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed
US-5061710-A Atrial natriuretic factors SCHERING CORPORATION (US) 1991-10-29 US disclosed
US-4929641-A DIURETICS, ANGIOTENSIN CONVERTING ENZYMES SCHERING CORPORATION (US) 1990-05-29 US disclosed
US-4801609-A Mercapto-acylamino acid antihypertensives SCHERING CORPORATION (US) 1989-01-31 US disclosed
US-4766110-A INHIBITS ANGIOTENSIN CONVERTING ENZYME, HYPOTENSIVE AGENTS RYAN JAMES W (US) 1988-08-23 US disclosed
EP-0254032-A2 Neutral metalloendopeptidase inhibitors in the treatment of hypertension SCHERING CORPORATION (US) 1988-01-27 EP disclosed
EP-0073143-A2 Novel complex amido and imido derivatives of carboxyalkyl peptides and thioethers and ethers of peptides Ryan, James Walter (US) 1983-03-02 EP disclosed