SCHEMBL17066147

SCHEMBL17066147

Cc1nc(C)nc(OCc2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
STAT3 P40763 1/20 0.47
HTT P42858 1/20 0.47
CYP1A2 P05177 3/20 0.44
ALOX5 P09917 1/20 0.44
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CLK4 Q9HAZ1 1/20 0.43
BRD4 O60885 1/20 0.43
LMNA P02545 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL16253511 0.96 L3MBTL1 (0.51) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL16253508 0.89 L3MBTL1 (0.46) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL17066149 0.88 L3MBTL1 (0.45) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL16253513 0.86 PAX8 (0.45) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL11009131 0.85 TSHR (0.52) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL16253514 0.84 LMNA (0.48) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL8669437 0.82 ALDH1A1 (0.55) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL1564355 0.77 ALDH1A1 (0.64) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL23406246 0.76 ALOX5 (0.44) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL808424 0.76 MGMT (0.53) L3MBTL1MAPTSMN1; SMN2STAT3HTT

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
US-9126954-B2 Hydroxy group protecting agent and hydroxy group protection method NATIONAL UNIVERSITY CORPORATION KANAZAWA UNIVERSITY (JP) 2015-09-08 US disclosed