SCHEMBL28683062

SCHEMBL28683062

COc1ccc(O)c(CN(Cc2ccccn2)Cc2ccccn2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LIN28A Q9H9Z2 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CHRNA7 P36544 2/20 0.46
SYK P43405 2/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44

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
SCHEMBL22992734 0.88 MAPT (0.49) KDM4EL3MBTL1MAPTSMN1; SMN2LIN28A
SCHEMBL29383167 0.88 MAPT (0.49) KDM4EL3MBTL1MAPTSMN1; SMN2LIN28A
SCHEMBL5050033 0.86 CHRNA7 (0.49) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL13955392 0.84 TSHR (0.47) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL22992875 0.82 KDM4E (0.44) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL3648829 0.82 NPSR1 (0.55) MAPTSMN1; SMN2LIN28ATDP1
SCHEMBL15211924 0.81 MAPT (0.54) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL15211851 0.81 MAPT (0.54) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL5050885 0.81 RAB9A (0.44) KDM4EMAPTSMN1; SMN2LIN28ATDP1
SCHEMBL13936668 0.81 TSHR (0.45) KDM4EMAPTSMN1; SMN2LIN28ATDP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114031647-A Binuclear cobalt complex and preparation method and application thereof 广西师范大学 2022-02-11 CN claimed
CN-114031647-A Binuclear cobalt complex and preparation method and application thereof 广西师范大学 2022-02-11 CN disclosed