SCHEMBL7082474

SCHEMBL7082474

CCC[C@H](NC(=O)OCc1ccccc1)C1NC1=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 9/20 0.51
CTSL P07711 10/20 0.50
CTSS P25774 5/20 0.50
IDO1 P14902 2/20 0.50
TDO2 P48775 1/20 0.50
ATM Q13315 1/20 0.47
CTRB1 P17538 2/20 0.47
CTSB P07858 1/20 0.47

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
SCHEMBL14299552 0.86 CTSK (0.46) CTSKCTSLCTSSIDO1TDO2
SCHEMBL19933193 0.79 CTRB1 (0.62) CTSKCTSLCTSSATMCTRB1
SCHEMBL19569920 0.78 POLB (0.61) CTSKCTSLCTSSATMCTRB1
SCHEMBL27351869 0.77 SYK (0.63) CTSKCTSLCTSSATMCTRB1
SCHEMBL22144261 0.77 CTSK (0.66) CTSKCTSLCTSSCTRB1CTSB
SCHEMBL6827337 0.77 CTSK (0.56) CTSKCTSLCTSSATMCTRB1
SCHEMBL329038 0.77 CTSK (0.66) CTSKCTSLCTSSCTSB
SCHEMBL265783 0.77 CTSK (0.66) CTSKCTSLCTSSCTSB
SCHEMBL20381057 0.77 CTSK (0.66) CTSKCTSLCTSSCTRB1CTSB
SCHEMBL265461 0.77 CTSK (0.66) CTSKCTSLCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1184388-B1 SULPHOSTIN ANALOGUES AND PROCESSES FOR THE PREPARATION OF SULPHOSTIN AND ANALOGUES THEREOF ZAIDAN HOJIN BISEIBUTSU (JP) 2003-07-30 EP disclosed
US-6579989-B1 Dipeptidylpeptidase IV inhibitors; hormone and immune modu-laters; anti-HIV and antiallergenic agents ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2003-06-17 US disclosed
EP-1184388-A1 SULPHOSTIN ANALOGUES AND PROCESSES FOR THE PREPARATION OF SULPHOSTIN AND ANALOGUES THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 2002-03-06 EP disclosed