SCHEMBL6942271

SCHEMBL6942271

CCOC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
RAB9A P51151 1/20 0.60
CTSL P07711 4/20 0.59
CTSS P25774 1/20 0.55
CTSK P43235 1/20 0.55
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
GLA P06280 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ACE P12821 3/20 0.52
TACR1 P25103 1/20 0.50

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
SCHEMBL28790851 0.87 CTSL (0.71) GAARAB9ACTSLCTSSCTSK
SCHEMBL3927028 0.87 CTSL (0.71) GAARAB9ACTSLCTSSCTSK
SCHEMBL6946429 0.84 CAPN1 (0.55) GAARAB9ACTSLCTSSCTSK
SCHEMBL7308097 0.84 CAPN1 (0.55) GAARAB9ACTSLCTSSCTSK
SCHEMBL14316003 0.84 L3MBTL1 (0.51) GAARAB9ACTSLCTSSCTSK
SCHEMBL6941033 0.83 CA12 (0.55) GAARAB9ASMN1; SMN2
SCHEMBL8696650 0.83 CTSL (0.60) CTSLCTSSCTSKALDH1A1TACR1
SCHEMBL12518333 0.82 CDYL2 (0.49) GAARAB9ACTSLCTSSCTSK
SCHEMBL1793176 0.81 GAA (0.76) GAARAB9ACTSLCTSSCTSK
SCHEMBL31206887 0.81 GAA (0.76) GAARAB9ACTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944582-B1 KETOBENZAMIDES AS CALPAIN INHIBITORS ABBOTT GMBH & CO KG (DE) 2003-07-02 EP disclosed
US-6103720-A ENZYME INHIBITORS; ANTIICHEMIC AND -TUMOR AGENTS; STROKES; ALZEIMER'S DISEASE BASF AKTIENGESELLSCHAFT (DE) 2000-08-15 US disclosed
EP-0944582-A1 KETOBENZAMIDES AS CALPAIN INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1999-09-29 EP disclosed
WO-1998025883-A1 KETOBENZAMIDES AS CALPAIN INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1998-06-18 WO disclosed