SCHEMBL28050640

SCHEMBL28050640

CN(C)C=c1cc(O)c(=CN(C)C)cc1O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 2/20 0.33
POLB P06746 2/20 0.33
THRB P10828 2/20 0.33
KMT2A Q03164 2/20 0.33
HKDC1 Q2TB90 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
G6PD P11413 2/20 0.33
GAA P10253 1/20 0.33
PABPC1 P11940 1/20 0.33
CYP2C9 P11712 2/20 0.31
ALOX15 P16050 2/20 0.31
HSD17B10 Q99714 2/20 0.31
SERPINE1 P05121 1/20 0.31
MAPK1 P28482 2/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL28050696 0.57 ALDH1A1 (0.39) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL21729845 0.55 APP (0.45) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL70123 0.54 MAPT (0.75) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL868703 0.53
SCHEMBL47929 0.52 ALDH1A1 (0.61) KDM4EALDH1A1MAPTTDP1G6PD
SCHEMBL29600339 0.50 KDM4E (0.67) KDM4EALDH1A1MAPTMEN1KMT2A
Catechol SCHEMBL27458543 0.50 ALDH1A1 (0.71) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL1259029 0.50 KDM4E (0.67) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL4592717 0.50 SELL (0.33) KDM4EALDH1A1MAPTG6PDCYP2C9
SCHEMBL395019 0.50 KDM4E (0.67) KDM4EALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105622971-A Preparation method for membrane material prepared from sulfonated polyimide containing nitrogen atoms at side chain CHEN YUMEI 2016-06-01 CN claimed
CN-105622971-A Preparation method for membrane material prepared from sulfonated polyimide containing nitrogen atoms at side chain CHEN YUMEI 2016-06-01 CN disclosed
CN-105622971-A Preparation method for membrane material prepared from sulfonated polyimide containing nitrogen atoms at side chain CHEN YUMEI 2016-06-01 CN disclosed