SCHEMBL7077833

SCHEMBL7077833

CC(C)(CNC(=O)O)Cc1ncc[nH]1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.45
TBXAS1 P24557 2/20 0.41
TAAR1 Q96RJ0 5/20 0.39
FPR2 P25090 1/20 0.38
GAA P10253 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HTR1A P08908 1/20 0.35
HTT P42858 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TERT O14746 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGES O14684 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
ADORA1 P30542 1/20 0.34
ALOX15 P16050 1/20 0.33

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
SCHEMBL4242018 0.83 FDPS (0.41) FDPSTBXAS1FPR2KDM4E
SCHEMBL6451096 0.79 FPR2 (0.55) FDPSTBXAS1TAAR1FPR2GAA
SCHEMBL12909221 0.76 FDPS (0.51) FDPSTBXAS1TAAR1FPR2GAA
SCHEMBL10838735 0.74 FDPS (0.54) FDPSTBXAS1TAAR1FPR2GAA
Hydrochloric Acid SCHEMBL10837985 0.73 FDPS (0.53) FDPSTBXAS1TAAR1FPR2GAA
SCHEMBL12909224 0.72 FDPS (0.56) FDPSTBXAS1TAAR1FPR2GAA
SCHEMBL7426540 0.72 TERT (0.54) FDPSTBXAS1TAAR1FPR2GAA
SCHEMBL4243603 0.72 FDPS (0.46) FDPSTBXAS1TAAR1SMN1; SMN2HTR1A
SCHEMBL2622405 0.70 FDPS (0.52) FDPSTBXAS1TAAR1SMN1; SMN2HTR1A
SCHEMBL19413146 0.70 FPR2 (0.50) FDPSTBXAS1TAAR1FPR2PTGES

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-1339400-A1 HYDROXAMIC ACID OR N-FORMYL HYDROXYLAMINE DERIVATIVES AS INHIBITORS OF BACTERIAL POLYPEPTIDE DEFORMYLASE FOR TREATING MICROBIAL INFECTIONS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2003-09-03 EP disclosed
WO-2002041886-A1 YDROXAMIC ACID OR N-FORMYL HYDROXYLAMINE DERIVATIVES AS INHIBITORS OF BAKTERIAL POLYPEPTIDE DEFORMYLASE FOR TREATING MICROBIAL INFECTIONS BRITISH BIOTECH PHARMACEUTICALS LTD (GB) 2002-05-30 WO disclosed