SCHEMBL6958952

SCHEMBL6958952

Cc1ccccc1CC(NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.54
CTSL P07711 2/20 0.54
CTSB P07858 1/20 0.54
CTSS P25774 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 1/20 0.53
ALOX15 P16050 1/20 0.53
ITGB3 P05106 5/20 0.53
ITGA2B P08514 5/20 0.53
CASP1 P29466 2/20 0.53
TACR1 P25103 2/20 0.52
CTRB1 P17538 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL16672133 0.89 TACR1 (0.55) CTSKCTSLCTSBCTSSNPC1
Hydrochloric Acid SCHEMBL27464326 0.86 L3MBTL1 (0.47) CTSLALDH1A1ITGB3L3MBTL1
SCHEMBL25178713 0.86 CTSK (0.48) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL25186527 0.86 CTSK (0.48) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL9825831 0.85 TYR (0.55) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL8889717 0.85 TYR (0.55) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL9826152 0.85 LMNA (0.61) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL220648 0.84 TACR1 (0.68) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL7372270 0.84 TACR1 (0.68) CTSKCTSLCTSBCTSSALDH1A1
SCHEMBL219151 0.84 TACR1 (0.68) CTSKCTSLCTSBCTSSALDH1A1

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-1021424-B1 THIADIAZOLE AMIDE MMP INHIBITORS UPJOHN CO (US) 2003-02-26 EP disclosed