SCHEMBL7344014

SCHEMBL7344014

CC(=O)OC(CCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.55
PPARA Q07869 7/20 0.55
MMP12 P39900 1/20 0.52
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.46
SRR Q9GZT4 2/20 0.46
ACE P12821 1/20 0.45

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
SCHEMBL7344016 1.00 PPARG (0.55) PPARGPPARAMMP12ALDH1A1TSHR
SCHEMBL27886769 0.87 MMP12 (0.47) PPARGPPARAMMP12ACE
SCHEMBL7495011 0.85 PPARG (0.61) PPARGPPARATSHRSRRACE
SCHEMBL17515671 0.85 MMP12 (0.49) PPARGPPARAMMP12ALDH1A1TSHR
SCHEMBL19486028 0.84 MMP12 (0.48) PPARGPPARAMMP12ALDH1A1TSHR
SCHEMBL9397557 0.84 SMN1; SMN2 (0.51) PPARGPPARAMMP12ALDH1A1TSHR
SCHEMBL2626716 0.82 SRR (0.62) PPARGPPARASRRACE
SCHEMBL2729126 0.82 PPARG (0.58) PPARGPPARAMMP12TSHRSRR
SCHEMBL1486321 0.82 SRR (0.62) PPARGPPARASRRACE
SCHEMBL6628870 0.82 PPARG (0.58) PPARGPPARAMMP12TSHRSRR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6258975-B1 HYPOTENSIVE AGENTS AJINOMOTO CO., INC. (JP) 2001-07-10 US disclosed
US-6087526-A Process for producing optically active 2-hydroxy-4-arylbutyric acid or its ester AJINOMOTO CO., INC. (JP) 2000-07-11 US disclosed
EP-0759424-B1 Process for producing optically active 2-hydroxy-4-arylbutyric acid or its ester, and intermediate therefor AJINOMOTO KK (JP) 2000-06-14 EP disclosed
US-5959139-A Process for producing optically active 2-hydroxy-4-arylbutyric acid or its ester AJINOMOTO CO., INC. (JP) 1999-09-28 US disclosed
EP-0759424-A1 Process for producing optically active 2-hydroxy-4-arylbutyric acid or its ester, and intermediate therefor Ajinomoto Co., Inc. (JP) 1997-02-26 EP disclosed
EP-0495822-A1 CARBOXYALKYL DIPEPTIDE INHIBITORS OF ENDOPEPTIDASES SCHERING CORPORATION (US) 1992-07-29 EP disclosed
WO-1991005796-A1 CARBOXYALKYL DIPEPTIDE INHIBITORS OF ENDOPEPTIDASES SCHERING CORPORATION (US) 1991-05-02 WO disclosed
US-4782149-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME, HYPOTENSIVES HOFFMAN-LA ROCHE INC. (US) 1988-11-01 US disclosed
US-4757069-A Hypotensive agents HOFFMANN-LA ROCHE INC. (US) 1988-07-12 US disclosed
EP-0271795-A2 Octahydro-10-oxo-6H-pyridazo[1,2-a][1,2]diazepin derivatives, intermediates and process for their preparation, and medicament containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-06-22 EP disclosed