SCHEMBL14637585

SCHEMBL14637585

CC(Cc1ccccc1)NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 5/20 0.55
▸ CTSS P25774 4/20 0.55
▸ CTSL P07711 1/20 0.55
▸ CTSB P07858 1/20 0.55
▸ PAX8 Q06710 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ PSMB8 P28062 1/20 0.52
▸ PSMB9 P28065 1/20 0.52
▸ PSMB5 P28074 1/20 0.52
▸ AKT1 P31749 1/20 0.52
▸ KLK7 P49862 2/20 0.51
▸ KLK5 Q9Y337 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ MMP1 P03956 1/20 0.51
▸ MMP3 P08254 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ CXCR3 P49682 1/20 0.51
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ PTPN1 P18031 1/20 0.49

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
SCHEMBL10135741 1.00 CTSK (0.55) CTSKCTSSCTSLCTSBPAX8
SCHEMBL13043257 0.97 CTSK (0.56) CTSKCTSSCTSLCTSBPAX8
SCHEMBL969253 0.95 PAX8 (0.53) CTSKCTSSCTSLCTSBPAX8
SCHEMBL18978665 0.94 CTSK (0.53) CTSKCTSSCTSLCTSBPAX8
SCHEMBL14684989 0.91 CTSK (0.51) CTSKCTSSCTSLCTSBPAX8
SCHEMBL18978668 0.91 CTSK (0.51) CTSKCTSSCTSLCTSBPAX8
SCHEMBL7922903 0.91 PAX8 (0.51) CTSKCTSSCTSLCTSBPAX8
SCHEMBL10241805 0.90 CTSK (0.53) CTSKCTSSCTSLCTSBAKT1
SCHEMBL13702233 0.89 ACE (0.59) CTSKCTSSCTSLCTSBPAX8
SCHEMBL16908988 0.89 ACE (0.59) CTSKCTSSCTSLCTSBPAX8

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
WO-2017098533-A2 PROCESS FOR PREPARATION OF LISDEXAMPHETAMINE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2017-06-15 — — WO disclosed
WO-2013011526-A1 PROCESS FOR PREPARATION OF LISDEXAMPHETAMINE AND SALTS THEREOF IND-SWIFT LABORATORIES LIMITED (IN) 2013-01-24 — — WO disclosed
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