SCHEMBL7349102

SCHEMBL7349102

CCC(C)C(NC(=O)C(C)NC1(C(=O)OC(C)(C)C)CCCCC1)C(=O)N[C@@H](Cc1ccc(C(C)(C)C)cc1)[C@@H](O)[C@@H](O)CC(C)C

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.41
CTSD P07339 4/20 0.41
BACE1 P56817 1/20 0.40

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
SCHEMBL7346470 0.91 REN (0.43) RENCTSDBACE1
SCHEMBL7358144 0.88 REN (0.54) RENCTSDBACE1
SCHEMBL7351757 0.85 CTSB (0.42) RENCTSDBACE1
SCHEMBL7351427 0.83 REN (0.46) REN
SCHEMBL7357022 0.82 REN (0.47) RENCTSD
SCHEMBL7349106 0.79 REN (0.47) RENCTSD
SCHEMBL7347690 0.77 REN (0.58) RENCTSD
SCHEMBL7350750 0.75 REN (0.49) RENCTSD
SCHEMBL9439729 0.73 REN (0.61) RENCTSD
SCHEMBL7354724 0.73 REN (0.46) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5338726-A Hypotensive agents, antiulcer agents ABBOTT LABORATORIES (US) 1994-08-16 US disclosed
EP-0569487-A4 1994-04-27 EP disclosed
EP-0569487-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1993-11-18 EP disclosed
WO-1992013545-A1 ENDOTHELIN CONVERTING ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1992-08-20 WO disclosed