SCHEMBL7410346

SCHEMBL7410346

C[C@@H]1C(=O)N(C(=O)OC(C)(C)C)[C@H]2CCN(C(=O)OCc3ccccc3)[C@H]12

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.58
F2 P00734 1/20 0.50
CTSG P08311 1/20 0.50

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
SCHEMBL7405101 0.90 PREP (0.54)
SCHEMBL7401667 0.85 ELANE (0.58) ELANE
SCHEMBL7511361 0.84 ELANE (0.60) ELANEF2CTSG
SCHEMBL7511367 0.84 ELANE (0.60) ELANEF2CTSG
SCHEMBL10170415 0.83 ELANE (0.50) ELANEF2CTSG
SCHEMBL2437607 0.82 ELANE (0.51) ELANE
SCHEMBL12299749 0.82 ELANE (0.51) ELANE
SCHEMBL8131836 0.82 ELANE (0.49) ELANEF2CTSG
SCHEMBL2632237 0.82 ELANE (0.49) ELANEF2CTSG
SCHEMBL34466304 0.81 ACE2 (0.49) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015454-A1 METHOD OF INHIBITING SERINE PROTEASE ENZYMES GLAXO GROUP LIMITED (GB) 2000-07-05 EP disclosed
WO-2000018770-A1 PYRROLOPYRROLONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXO GROUP LIMITED (GB) 2000-04-06 WO disclosed
EP-0973775-A1 PYROLOPYRROLONE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-01-26 EP disclosed
WO-1999012932-A1 METHOD OF INHIBITING SERINE PROTEASE ENZYMES GLAXO GROUP LIMITED (GB) 1999-03-18 WO disclosed
WO-1998043975-A1 PYROLOPYRROLONE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-10-08 WO disclosed