SCHEMBL7368655

SCHEMBL7368655

CC(C)[C@H](NC(=O)C(Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MME P08473 8/20 0.54
ECE1 P42892 5/20 0.53
LTA4H P09960 3/20 0.48
ACE P12821 1/20 0.45
ANPEP P15144 1/20 0.45
ALDH1A1 P00352 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
SCHEMBL6451867 1.00 MME (0.54) MMEECE1LTA4HACEANPEP
SCHEMBL6451863 1.00 MME (0.54) MMEECE1LTA4HACEANPEP
SCHEMBL10439584 0.83 HRH4 (0.46) MMEECE1ACEALDH1A1
SCHEMBL9848463 0.83 MME (0.43) MMEECE1LTA4HACEANPEP
SCHEMBL6443855 0.83 MME (0.67) MMEECE1LTA4H
SCHEMBL6443861 0.83 MME (0.67) MMEECE1LTA4H
SCHEMBL7290825 0.83 REN (0.41) MMEECE1LTA4H
SCHEMBL7330319 0.81 MAPK1 (0.58) MMELTA4H
SCHEMBL7163321 0.81 CYP1A2 (0.59) MMEANPEP
SCHEMBL7269232 0.81 CYP1A2 (0.59) MMEANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0354522-A1 Use of alpha-aminoboronic acid derivatives in prevention and treatement of viral diseases HOECHST AKTIENGESELLSCHAFT (DE) 1990-02-14 EP disclosed
EP-0315574-A2 Renin inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-10 EP disclosed