SCHEMBL7270097

SCHEMBL7270097

O=C(O)C(=O)CCc1c[nH]c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.71
MEN1 O00255 5/20 0.71
MAPT P10636 4/20 0.71
ALDH1A1 P00352 2/20 0.71
HPGD P15428 2/20 0.71
KDM4E B2RXH2 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
GAA P10253 1/20 0.64
PDPK1 O15530 1/20 0.62
CDK4 P11802 1/20 0.59
SLC6A2 P23975 1/20 0.59
FNTA P49354 1/20 0.59
FNTB P49356 1/20 0.59
HTT P42858 1/20 0.58
RECQL P46063 1/20 0.58
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
FAAH O00519 1/20 0.56
CYP1A2 P05177 2/20 0.56
LMNA P02545 1/20 0.56

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
Indolylpropionic Acid SCHEMBL195405 0.87 MAPT (0.68) KMT2AMEN1MAPTALDH1A1HPGD
Indolylpropionic Acid SCHEMBL29521227 0.87 MAPT (0.68) KMT2AMEN1MAPTALDH1A1HPGD
Indolylpropionic Acid SCHEMBL29374161 0.87 MAPT (0.68) KMT2AMEN1MAPTALDH1A1HPGD
Indolylpropionic Acid SCHEMBL2115660 0.85 MAPT (0.66) KMT2AMEN1MAPTALDH1A1HPGD
Indolylpropionic Acid SCHEMBL29272702 0.85 MAPT (0.66) KMT2AMEN1MAPTALDH1A1HPGD
Indolylpropionic Acid SCHEMBL2115658 0.84 MAPT (0.64) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL125249 0.83 MEN1 (1.00) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL28378507 0.83 MAPT (0.68) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL29362070 0.83 MEN1 (1.00) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL27763159 0.83 MEN1 (1.00) KMT2AMEN1MAPTALDH1A1HPGD

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-5348944-A Hypotensive agents SCHERING CORPORATION (US) 1994-09-20 US disclosed
US-4766110-A INHIBITS ANGIOTENSIN CONVERTING ENZYME, HYPOTENSIVE AGENTS RYAN JAMES W (US) 1988-08-23 US disclosed
EP-0073143-B1 NOVEL COMPLEX AMIDO AND IMIDO DERIVATIVES OF CARBOXYALKYL PEPTIDES AND THIOETHERS AND ETHERS OF PEPTIDES Ryan, James Walter (US) 1985-11-21 EP disclosed
US-4472380-A CARBOXYALKYL DIPEPTIDE DERIVATIVES MERCK & CO., INC. (US) 1984-09-18 US 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
US-4374829-A Aminoacid derivatives as antihypertensives MERCK & CO., INC. (US) 1983-02-22 US disclosed
EP-0050800-A1 Carboxyalkyl dipeptides, processes for their production and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1982-05-05 EP disclosed
EP-0048159-A2 Novel carboxyalkyl peptides and thioethers and ethers of peptides as antihypertensive agents UNIVERSITY OF MIAMI (US) 1982-03-24 EP disclosed
EP-0012401-A1 Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them MERCK & CO. INC. (US) 1980-06-25 EP disclosed