SCHEMBL7302277

SCHEMBL7302277

N=C(N)NCCC[C@@H](C(=O)O)N(CCNC(=O)c1ccccc1)C(=O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
F10 P00742 1/20 0.40
CA2 P00918 1/20 0.38
TPSAB1 Q15661 1/20 0.37
TPH1 P17752 1/20 0.37
SLC7A5 Q01650 2/20 0.37
ALPI P09923 1/20 0.37
PKM P14618 1/20 0.37
PTGS1 P23219 1/20 0.37
XIAP P98170 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
EPHX2 P34913 1/20 0.36
ANPEP P15144 1/20 0.36
RNPEP Q9H4A4 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
SCHEMBL9390635 0.87 ANPEP (0.40) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL8374436 0.87 ANPEP (0.40) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL9394697 0.87 ANPEP (0.40) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL7566039 0.83 ANPEP (0.37) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL11599296 0.83 FOLH1 (0.38) TPH1SLC7A5ALPIPKMPTGS1
SCHEMBL27913200 0.81 ANPEP (0.43) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL27913206 0.81 ANPEP (0.43) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL5636527 0.80 ALPI (0.40) TPH1SLC7A5ALPIPKMPTGS1
SCHEMBL2465468 0.78 MMP2 (0.36)
SCHEMBL6049152 0.77 ANPEP (0.39) SLC7A5ALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1068586-C Crystalline, polymorphic form of (S,S,S)-n-(1-[2-carboxy-3-(n2-mesyllysylamino)propyl]-1-cyclopenlylcarbonyl)tyrosine PFIZER RES & DEV CO N V S A (IE) 2001-07-18 CN disclosed
US-6180665-B1 HYPOTENSIVE AGENTS; ANGIOTENSIN CONVERTING ENZYME INHIBITOR PFIZER INC. 2001-01-30 US disclosed
EP-0731787-B1 CRYSTALLINE, POLYMORPHIC FORM OF (S,S,S)-N-(1-[2-CARBOXY-3-(N2-MESYLLYSYLAMINO)PROPYL]-1-CYCLOPENTYLCARBONYL)TYROSINE PFIZER LTD (GB) 1999-01-13 EP disclosed
CN-1142816-A Crystalline, polymorphic form of (S,S,S)-n-(1-[2-carboxy-3-(n2-mesyllysylamino)propyl]-1-cyclopenlylcarbonyl)tyrosine PFIZER LTD (IE) 1997-02-12 CN disclosed
CN-1031051-C Cycloalkyl-substituted glutaramide antihypertensive agents PFIZER (US) 1996-02-21 CN disclosed
US-5362902-A Diuretics and treatment of cardiovascular disorders PFIZER INC. (US) 1994-11-08 US disclosed
EP-0358398-B1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS Pfizer Limited (GB) 1993-03-10 EP disclosed
US-5192800-A Hypotensive agents PFIZER INC. (US) 1993-03-09 US disclosed
CN-1016778-B spiro-substituted glutaric acid monoamides PFIZER LTD (GB) 1992-05-27 CN disclosed
EP-0274234-B1 SPIRO-SUBSITUTED GLUTARAMIDE DIURETIC AGENTS Pfizer Limited (GB) 1991-09-11 EP disclosed
US-5036104-A ENZYME INHIBITORS PFIZER INC. (US) 1991-07-30 US disclosed
US-5030654-A Glutaramide diuretic agents PFIZER INC. (US) 1991-07-09 US disclosed
US-4975444-A INHIBITORS OF ANGIORENSIN-CONVERTING ENZYME AS WELL AS A ENDOPEPTIDASE; CARDIOTONIC AGENTS; GLAUCOMA; DIURETICS PFIZER INC. (US) 1990-12-04 US disclosed
US-4960792-A HYPOTENSIVE AGENTS PFIZER INC. (US) 1990-10-02 US disclosed
WO-1990009374-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS PFIZER LIMITED (GB) 1990-08-23 WO disclosed
CN-1040986-A The preparation of the glutaramide derivatives of cycloalkyl substituted PFIZER (US) 1990-04-04 CN disclosed
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP disclosed
EP-0274234-A2 Spiro-subsituted glutaramide diuretic agents Pfizer Limited (GB) 1988-07-13 EP disclosed
CN-87107371-A The glutaramide diuretic agents of spiral shell-replacement 1988-07-06 CN disclosed