SCHEMBL28297325

SCHEMBL28297325

CCOC(=O)c1nc(-c2ccc(OC)cc2)[nH]c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
TP53 P04637 2/20 0.60
HSD17B10 Q99714 2/20 0.60
TARBP2 Q15633 2/20 0.57
PDCD4 Q53EL6 1/20 0.57
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
HCRTR1 O43613 1/20 0.52
MAPT P10636 5/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
PIN1 Q13526 2/20 0.51
GABRA2 P47869 2/20 0.49
GABRB2 P47870 1/20 0.49
HTT P42858 2/20 0.49
MAPK10 P53779 1/20 0.49
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47

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
SCHEMBL4382123 0.86 KDM4E (0.57) KDM4ESMN1; SMN2TP53HSD17B10TARBP2
SCHEMBL22678558 0.85 KDM4E (0.56) KDM4ESMN1; SMN2TP53HSD17B10TARBP2
SCHEMBL27475261 0.85 PIN1 (0.68) KDM4ESMN1; SMN2TP53HSD17B10TARBP2
SCHEMBL8964177 0.83 PIN1 (0.56) KDM4ESMN1; SMN2GAAMAPTNPC1
SCHEMBL17803252 0.82 KDM4E (0.58) KDM4ESMN1; SMN2TP53HSD17B10MAPT
SCHEMBL28297288 0.81 GAA (0.58) KDM4ESMN1; SMN2TP53HSD17B10TARBP2
SCHEMBL8964001 0.81 PIN1 (0.51) KDM4ESMN1; SMN2TP53GAAHCRTR1
SCHEMBL7988102 0.79 MAPT (0.54) SMN1; SMN2TARBP2PDCD4POLBGAA
SCHEMBL11863144 0.79 MAPT (0.49) KDM4ESMN1; SMN2TP53HSD17B10TARBP2
SCHEMBL7989867 0.78 SIRT2 (0.58) SMN1; SMN2TP53TARBP2PDCD4POLB

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-109810071-A A kind of miRNA biosynthesis inhibitor 中国科学院成都生物研究所 2019-05-28 CN disclosed