SCHEMBL7512018

SCHEMBL7512018

CCOC(=O)c1c(C)n[nH]c1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.54
SMN1; SMN2 Q16637 4/20 0.52
RAB9A P51151 4/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.50
NPSR1 Q6W5P4 2/20 0.48
MEN1 O00255 1/20 0.47
HSP90AA1 P07900 1/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.46
TP53 P04637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NR1H4 Q96RI1 1/20 0.44
ADORA3 P0DMS8 2/20 0.44
GABRA1 P14867 1/20 0.44

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
SCHEMBL18873552 0.79 PDE4D (0.61) PDE4DSMN1; SMN2RAB9AKMT2ANPC1
SCHEMBL7512103 0.79 SMN1; SMN2 (0.62) PDE4DSMN1; SMN2RAB9AKMT2ANPC1
SCHEMBL6228465 0.77 KMT2A (0.51) PDE4DSMN1; SMN2RAB9AKMT2ANPC1
SCHEMBL27559208 0.75 GAA (0.58) SMN1; SMN2RAB9AKMT2ANPC1MEN1
SCHEMBL19209480 0.75 PDE4D (0.59) PDE4DSMN1; SMN2RAB9AKMT2ANPC1
SCHEMBL3263722 0.75 HPGDS (0.57) SMN1; SMN2RAB9ANPC1NPSR1KDM4E
SCHEMBL318281 0.74 NPC1 (0.47) SMN1; SMN2RAB9AKMT2ANPC1MEN1
SCHEMBL24906443 0.74 RAB9A (0.53) SMN1; SMN2RAB9AKMT2ANPC1NPSR1
SCHEMBL6415504 0.74 HPGDS (0.56) SMN1; SMN2RAB9AKMT2ANPC1MEN1
SCHEMBL1590178 0.73 KMT2A (0.52) SMN1; SMN2RAB9AKMT2ANPC1MEN1

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-1204643-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION Dow AgroSciences LLC (US) 2002-05-15 EP disclosed
EP-1196388-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION Dow AgroSciences LLC (US) 2002-04-17 EP disclosed
WO-2001014339-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION DOW AGROSCIENCES LLC (US) 2001-03-01 WO disclosed
WO-2001005769-A2 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION DOW AGROSCIENCES LLC (US) 2001-01-25 WO disclosed