SCHEMBL18978668

SCHEMBL18978668

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

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 5/20 0.51
▸ CTSS P25774 4/20 0.51
▸ CTSL P07711 1/20 0.51
▸ CTSB P07858 1/20 0.51
▸ AKT1 P31749 1/20 0.48
▸ CXCR3 P49682 1/20 0.47
▸ KLK7 P49862 1/20 0.46
▸ KLK5 Q9Y337 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ PSMB8 P28062 1/20 0.46
▸ PSMB9 P28065 1/20 0.46
▸ PSMB5 P28074 1/20 0.46
▸ SIRT5 Q9NXA8 1/20 0.45
▸ MAPT P10636 1/20 0.45

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
SCHEMBL14637585 0.91 CTSK (0.55) CTSKCTSSCTSLCTSBAKT1
SCHEMBL10135741 0.91 CTSK (0.55) CTSKCTSSCTSLCTSBAKT1
SCHEMBL18978665 0.89 CTSK (0.53) CTSKCTSSCTSLCTSBAKT1
SCHEMBL13043257 0.88 CTSK (0.56) CTSKCTSSCTSLCTSBAKT1
SCHEMBL14684989 0.86 CTSK (0.51) CTSKCTSSCTSLCTSBAKT1
SCHEMBL969253 0.86 PAX8 (0.53) CTSKCTSSCTSLCTSBAKT1
SCHEMBL10241805 0.85 CTSK (0.53) CTSKCTSSCTSLCTSBAKT1
SCHEMBL10242762 0.85 CTSK (0.49) CTSKCTSSCTSLCTSBAKT1
SCHEMBL12947678 0.84 CTSK (0.54) CTSKCTSSCTSLCTSBAKT1
SCHEMBL880800 0.83 CTSK (0.47) CTSKCTSSCTSLCTSBAKT1

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
WO-2017098533-A2 PROCESS FOR PREPARATION OF LISDEXAMPHETAMINE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2017-06-15 — — WO disclosed
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