SCHEMBL7360719

SCHEMBL7360719

CC(C)CCC(NC(=O)NC(C)(C)C)[C@H](O)[C@H](Cc1ccccc1)NC(=O)CN(C(C)(C)C)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.36
CTSD P07339 2/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
REN P00797 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SPPL2A Q8TCT8 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL8899924 0.90 BACE1 (0.36) BACE1CTSDRENNPC1RAB9A
SCHEMBL7353583 0.88 BACE1 (0.37) BACE1CTSDBACE2REN
SCHEMBL8897548 0.87 BACE1 (0.33) BACE1CTSDRENSPPL2A
SCHEMBL7476233 0.86 SPPL2A (0.38) BACE1CTSDSPPL2A
SCHEMBL8606263 0.82 BACE1 (0.35) BACE1RENNPC1RAB9AMAPT
SCHEMBL7360716 0.82 BACE1 (0.36) BACE1CTSDRENNPC1RAB9A
SCHEMBL8840299 0.82 BACE1 (0.40) BACE1RENNPC1RAB9AMAPT
SCHEMBL7358895 0.78 REN (0.38) CTSDREN
SCHEMBL8897311 0.76 REN (0.38) RENNPC1RAB9AMAPT
SCHEMBL8897322 0.76 REN (0.38) RENNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5614522-A SULFONAMIDE AND UREA-CONTAINING HYDROXYETHYLAMINE COMPOUNDS G.D. SEARLE & CO. (US) 1997-03-25 US disclosed
EP-0558673-A1 RETROVIRAL PROTEASE INHIBITORS. MONSANTO CO (US) 1993-09-08 EP disclosed
WO-1992008699-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 WO disclosed