SCHEMBL7510900

SCHEMBL7510900

CC(CN1CCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.48
CTSL P07711 2/20 0.48
CTSB P07858 1/20 0.48
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CYP2D6 P10635 1/20 0.41
PREP P48147 1/20 0.40
CTSS P25774 2/20 0.39
HDAC4 P56524 2/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL18534563 1.00 CTSK (0.48) CTSKCTSLCTSBCA1CA2
SCHEMBL12420756 1.00 CTSK (0.48) CTSKCTSLCTSBCA1CA2
SCHEMBL28669035 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
SCHEMBL21125085 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
SCHEMBL18215140 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
Ammonia Solution, Strong SCHEMBL4701521 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
SCHEMBL4824903 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
SCHEMBL4703911 0.98 CTSK (0.47) CTSKCTSLCTSBCA1CA2
SCHEMBL4773114 0.88 CA1 (0.46) CTSKCTSLCTSBCA1CA2
SCHEMBL357027 0.86 CTSK (0.49) CTSKCTSLCTSBCA1CA2

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-1255739-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2002-11-13 EP disclosed
WO-2001053273-A1 3-AMINOQUINAZOLIN-2,4-DIONE ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 2001-07-26 WO disclosed