SCHEMBL13886178

SCHEMBL13886178

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.61
CTSS P25774 5/20 0.60
CTSL P07711 5/20 0.60
CTSB P07858 3/20 0.60
CTSK P43235 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
CHRNB2 P17787 1/20 0.52
CHRNB4 P30926 1/20 0.52
CHRNA3 P32297 1/20 0.52
CHRNA4 P43681 1/20 0.52
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
MME P08473 2/20 0.50
ANPEP P15144 1/20 0.50
ACE P12821 1/20 0.50
CPA1 P15085 1/20 0.50
ACE2 Q9BYF1 1/20 0.50

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
SCHEMBL23154438 0.88 L3MBTL1 (0.68) PSMB5CTSSCTSLCTSBCTSK
SCHEMBL16484810 0.88 CTSS (0.58) PSMB5CTSSCTSLCTSBCTSK
SCHEMBL988507 0.88 CHRNB2 (0.65) PSMB5CTSSCTSLCTSBCTSK
SCHEMBL16484787 0.88 CTSS (0.58) PSMB5CTSSCTSLCTSBCTSK
SCHEMBL15692319 0.88 PSMB5 (0.64) PSMB5HDAC3HDAC4HDAC1HDAC2
SCHEMBL11404183 0.88 CTSS (0.58) CTSSCTSLCTSBCTSKL3MBTL1
SCHEMBL10076052 0.87 ACE (0.61) PSMB5L3MBTL1MMEACECPA1
SCHEMBL3704677 0.87 ACE (0.61) PSMB5L3MBTL1MMEACECPA1
SCHEMBL4182347 0.87 ACE (0.61) PSMB5L3MBTL1MMEACECPA1
SCHEMBL21128010 0.87 CTSS (0.56) PSMB5CTSSCTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524883-B2 Eponemycin and epoxomicin analogs and uses thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed