SCHEMBL8553062

SCHEMBL8553062

CC(C)c1nn(-c2ccccc2)c(N)c1C#N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.61
MAPT P10636 10/20 0.48
LMNA P02545 6/20 0.48
ALDH1A1 P00352 6/20 0.48
HPGD P15428 5/20 0.48
SMN1; SMN2 Q16637 7/20 0.45
TDP1 Q9NUW8 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
PIK3CG P48736 1/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL13860340 0.85 GAA (0.57) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL6205595 0.83 HTT (0.46) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL2546236 0.81 GAA (0.68) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL11546523 0.79 GAA (0.65) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL1179221 0.78 GABRP (0.43) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL13858699 0.78 TDP1 (0.52) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL3994806 0.76 GAA (0.61) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL3615656 0.76 GAA (0.61) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL13860443 0.76 GAA (1.00) GAAMAPTLMNAALDH1A1HPGD
SCHEMBL574674 0.76 GAA (0.65) GAAMAPTLMNAALDH1A1HPGD

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-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed