SCHEMBL9832260

SCHEMBL9832260

CC(C)OCC(F)(F)C(=O)[C@@H](N)CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.36
CTSL P07711 2/20 0.36
CTSB P07858 2/20 0.36
SLC1A3 P43003 3/20 0.35
SLC1A2 P43004 3/20 0.35
SLC1A1 P43005 3/20 0.35
CTSH P09668 1/20 0.35
REN P00797 1/20 0.35
METAP2 P50579 2/20 0.33
METAP1 P53582 1/20 0.32

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
SCHEMBL7051728 0.78 REN (0.35) CTSKCTSLCTSBCTSHREN
SCHEMBL7589493 0.78 REN (0.35) CTSKCTSLCTSBCTSHREN
SCHEMBL9832812 0.78 REN (0.35) CTSKCTSLCTSBCTSHREN
SCHEMBL7440693 0.77 REN (0.38) CTSKCTSLCTSBCTSHREN
SCHEMBL7440684 0.77 REN (0.38) CTSKCTSLCTSBCTSHREN
SCHEMBL17789278 0.74 METAP1 (0.40) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL30415115 0.74 METAP1 (0.40) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL9831663 0.73 REN (0.38) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL7589499 0.73 REN (0.36) CTSKCTSLCTSBCTSHREN
SCHEMBL7051735 0.73 REN (0.36) CTSKCTSLCTSBCTSHREN

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
EP-0258289-A4 PEPTIDE ANALOGS 1991-01-02 EP disclosed
US-4857507-A HYPOTENSIVE AGENT ABBOTT LABORATORIES (US) 1989-08-15 US disclosed
EP-0258289-A1 PEPTIDE ANALOGS ABBOTT LABORATORIES (US) 1988-03-09 EP disclosed
WO-1987004349-A1 PEPTIDE ANALOGS DELLARIA JOSEPH 1987-07-30 WO disclosed