SCHEMBL6623558

SCHEMBL6623558

COC(=O)C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CCN1C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CTSL P07711 1/20 0.42
CPB1 P15086 1/20 0.41

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
SCHEMBL6623570 1.00 PDE4B (0.47) PDE4BHTTKMT2AL3MBTL1NPC1
SCHEMBL6623564 1.00 PDE4B (0.47) PDE4BHTTKMT2AL3MBTL1NPC1
SCHEMBL6619512 0.92 PDE4B (0.44) PDE4BHTTKMT2AL3MBTL1CTSL
SCHEMBL7366503 0.92 PDE4B (0.44) PDE4BHTTKMT2AL3MBTL1CTSL
SCHEMBL6619305 0.92 PDE4B (0.44) PDE4BHTTKMT2AL3MBTL1CTSL
SCHEMBL6619271 0.92 PDE4B (0.44) PDE4BHTTKMT2AL3MBTL1CTSL
SCHEMBL2185018 0.90 KMT2A (0.48) PDE4BHTTKMT2AL3MBTL1NPC1
SCHEMBL6621482 0.88 PDE4B (0.46) PDE4BHTTKMT2AL3MBTL1NPC1
SCHEMBL4342264 0.87 L3MBTL1 (0.46) PDE4BKMT2AL3MBTL1SMN1; SMN2
SCHEMBL4342256 0.87 L3MBTL1 (0.46) PDE4BKMT2AL3MBTL1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891362-B1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LTD (GB) 2004-03-17 EP disclosed
US-6215002-B1 CYCLIZATION, DEBLOCKING, DEPROTECTION, SULFONATION, CONDENSATION, AMIDATION; ANTIINFLAMMATORY AGENTS; RESPIRATORY SYSTEM DISORDERS GLAXO WELLCOME INC. 2001-04-10 US disclosed
US-6057457-A ENZYME INHIBITORS FOR PROTEASE OR ENZYMES OF HYDROLYSIS GLAXO WELLCOME INC. (US) 2000-05-02 US disclosed
US-5994344-A BRONCHITIS THERAPY GLAXO WELLCOME INC. (US) 1999-11-30 US disclosed
EP-0891362-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1999-01-20 EP disclosed
WO-1997036903-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1997-10-09 WO disclosed