SCHEMBL28800162

SCHEMBL28800162

CCOC(=O)c1c(C)nc(C)n1-c1ccc(CC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.50
HTT P42858 2/20 0.50
MAPT P10636 4/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 1/20 0.49
MAPK1 P28482 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
ATM Q13315 1/20 0.46
HCAR1 Q9BXC0 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
APOBEC3G Q9HC16 1/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 2/20 0.43
ALOX15 P16050 2/20 0.43
HCRTR1 O43613 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HSP90AA1 P07900 1/20 0.41
CACNA1B Q00975 1/20 0.41

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
SCHEMBL28800129 0.90 HTT (0.51) HPGDHTTMAPTALDH1A1GAA
SCHEMBL28800137 0.87 POLB (0.52) HPGDHTTMAPTALDH1A1GAA
SCHEMBL28800159 0.87 KMT2A (0.56) HPGDHTTMAPTALDH1A1GAA
SCHEMBL27769609 0.87 ALDH1A1 (0.66) HPGDHTTMAPTALDH1A1GAA
SCHEMBL28800122 0.85 RAB9A (0.48) MAPTALDH1A1GAAMAPK1SMN1; SMN2
SCHEMBL28800153 0.84 MAPT (0.46) HPGDHTTMAPTALDH1A1GAA
SCHEMBL28800120 0.83 POLB (0.52) HPGDHTTMAPTALDH1A1GAA
SCHEMBL15004788 0.80 ALDH1A1 (0.73) HPGDHTTMAPTALDH1A1GAA
SCHEMBL28800116 0.79 GABRA2 (0.52) HPGDHTTMAPTALDH1A1GAA
SCHEMBL29800446 0.79 GABRA2 (0.52) HPGDHTTMAPTALDH1A1GAA

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
CN-114790176-A Imidazole compound and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-07-26 CN disclosed