SCHEMBL7347648

SCHEMBL7347648

CC(C)(C)OC(=O)N[C@H]1CCCC(CC=O)N(CC(=O)O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PRSS1 P07477 1/20 0.42
BTK Q06187 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 1/20 0.37
ACE P12821 2/20 0.36
EPHX1 P07099 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
SCHEMBL7350200 0.90 F2 (0.42) F2F10PRSS1BTKKMT2A
SCHEMBL7350194 0.90 F2 (0.42) F2F10PRSS1BTKKMT2A
SCHEMBL7339770 0.86 F2 (0.43) F2F10PRSS1BTKKMT2A
SCHEMBL7339777 0.86 F2 (0.43) F2F10PRSS1BTKKMT2A
SCHEMBL8837664 0.83 ACE (0.48) F2F10PRSS1BTKKMT2A
SCHEMBL8837673 0.83 ACE (0.48) F2F10PRSS1BTKKMT2A
SCHEMBL8837660 0.83 ACE (0.48) F2F10PRSS1BTKKMT2A
SCHEMBL7396333 0.80 GAA (0.40) F2F10PRSS1BTKKMT2A
SCHEMBL7339763 0.79 F2 (0.43) F2F10PRSS1BTKKMT2A
SCHEMBL10907376 0.76 F2 (0.40) F2F10PRSS1BTKKMT2A

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-0599444-B1 Dual action inhibitors SQUIBB & SONS INC (US) 1998-01-28 EP disclosed
US-5654294-A CARDIOVASCULAR DISORDERS BRISTOL-MYERS SQUIBB (US) 1997-08-05 US disclosed
EP-0783002-A2 Dual action inhibitors E.R. SQUIBB & SONS, INC. (US) 1997-07-09 EP disclosed
US-5646276-A ANGIOTENSIN CONVERTING ENZYME AND NEUTRAL ENDOPEPTIDASE INHIBITORS; CARDIOVASCULAR DISORDERS BRISTOL-MYERS SQUIBB CO. (US) 1997-07-08 US disclosed
US-5552397-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1996-09-03 US disclosed
EP-0599444-A1 Dual action inhibitors E.R. SQUIBB & SONS, INC. (US) 1994-06-01 EP disclosed