SCHEMBL21574166

SCHEMBL21574166

CN(CCCN1CCOCC1)CCN(C)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ACHE P22303 2/20 0.37
BCHE P06276 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
PAOX Q6QHF9 1/20 0.36
TSHR P16473 1/20 0.36
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL20688772 0.92 CTSD (0.44) CTSDCTSLCTSBCTSSNPSR1
SCHEMBL16932535 0.86 NPSR1 (0.42) CTSDCTSLCTSBCTSSNPSR1
SCHEMBL2376936 0.86 CTSD (0.46) CTSDCTSLCTSBCTSSSMN1; SMN2
SCHEMBL16932537 0.82 PAOX (0.51) CTSDCTSLCTSBCTSSSMN1; SMN2
SCHEMBL16932531 0.82 PAOX (0.51) CTSDCTSLCTSBCTSSSMN1; SMN2
SCHEMBL76415 0.79 HRH3 (0.45) CTSDCTSLCTSBCTSSNPSR1
SCHEMBL7783463 0.79 HDAC6 (0.38) MEN1KMT2A
SCHEMBL7334634 0.77 SMN1; SMN2 (0.51) CTSDCTSLCTSBCTSSSMN1; SMN2
SCHEMBL1033434 0.77 KEAP1 (0.54) NPSR1SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL9358875 0.77 POLB (0.47) SMN1; SMN2ALDH1A1LMNAKMT2ACD274

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
EP-3099691-B1 PRO-SUBSTRATES FOR LIVE CELL APPLICATIONS PROMEGA CORP (US) 2019-11-20 EP disclosed