SCHEMBL7863246

SCHEMBL7863246

C[C@H](NC(=O)OCc1ccccc1)C(=O)c1c[nH]cn1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.50
CTSK P43235 4/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48
ELANE P08246 2/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 2/20 0.45
MAPT P10636 1/20 0.45
PRTN3 P24158 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
SCHEMBL8095110 0.80 ATM (0.49) ATMCTSKCTSLCTSBCTSS
SCHEMBL6841180 0.80 ATM (0.51) ATMCTSKCTSLCTSBCTSS
SCHEMBL10554014 0.79 CTSK (0.48) ATMCTSKCTSLCTSBCTSS
SCHEMBL29576042 0.78 CTSK (0.50) CTSKCTSLCTSBCTSS
SCHEMBL10583222 0.77 CTSK (0.49) CTSKCTSB
SCHEMBL10684888 0.77 CTSK (0.49) CTSKCTSB
SCHEMBL8087046 0.77 KDM4C (0.54) ATMCTSKCTSLCTSBCTSS
SCHEMBL1437776 0.76 TDP1 (0.53) LMNAKMT2ATDP1
SCHEMBL856196 0.76 CTSK (0.61) ATMCTSKCTSLCTSBCTSS
SCHEMBL241564 0.76 CTSK (0.61) ATMCTSKCTSLCTSBCTSS

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
EP-1076663-A1 FUNCTIONALIZED ALKYL AND ALKENYL SIDE CHAIN DERIVATIVES OF GLYCINAMIDES AS FARNESYL TRANSFERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-02-21 EP disclosed
WO-1999055725-A1 FUNCTIONALIZED ALKYL AND ALKENYL SIDE CHAIN DERIVATIVES OF GLYCINAMIDES AS FARNESYL TRANSFERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1999-11-04 WO disclosed