SCHEMBL28512143

SCHEMBL28512143

NC(=O)Oc1nc(-c2cccc(N3CCOCC3)n2)cs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.42
PIM1 P11309 3/20 0.42
PIM3 Q86V86 3/20 0.42
ADORA2A P29274 2/20 0.41
ADORA1 P30542 2/20 0.41
IRAK4 Q9NWZ3 1/20 0.39
GAA P10253 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCQ Q04759 1/20 0.39
PIM2 Q9P1W9 2/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HTR2C P28335 2/20 0.37
AKT1 P31749 1/20 0.37
PIK3CA P42336 1/20 0.37

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
SCHEMBL28528175 0.84 ADK (0.47) IRAK4ALDH1A1HPGD
SCHEMBL21495017 0.79 AR (0.50) ARPIM1PIM3GAAPIM2
SCHEMBL26127740 0.75 CCR1 (0.46) RAB9ANPC1SMN1; SMN2ALDH1A1POLB
SCHEMBL28519673 0.72 LMNA (0.44) ADORA2AADORA1SMN1; SMN2HSD17B10ALDH1A1
SCHEMBL2815393 0.71 IRAK4 (0.60) PIM1PIM3IRAK4GAAPRKCA
SCHEMBL21495084 0.70 MAPT (0.53) ADORA2AADORA1RAB9ANPC1SMN1; SMN2
SCHEMBL28818217 0.69 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1HPGDKDM4EHTT
SCHEMBL6843345 0.68 GAA (0.59) GAASMN1; SMN2HSD17B10ALDH1A1HPGD
SCHEMBL16834405 0.68 GAA (0.50) IRAK4GAANPC1HSD17B10ALDH1A1
SCHEMBL21495079 0.68 MAPT (0.48) RAB9ANPC1HSD17B10ALDH1A1HPGD

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-112313229-A Substituted aminothiazoles as inhibitors of nucleases 马萨里克大学 2021-02-02 CN disclosed