SCHEMBL28044712

SCHEMBL28044712

NNC(=O)Cn1c2ccccc2c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.61
MPO P05164 1/20 0.56
KMT2A Q03164 1/20 0.55
HDAC6 Q9UBN7 5/20 0.53
MMP2 P08253 1/20 0.52
KRAS P01116 1/20 0.52
GLA P06280 1/20 0.51
TSPO P30536 1/20 0.51
NPC1 O15118 1/20 0.51
PLA2G2A P14555 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
RCE1 Q9Y256 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HDAC1 Q13547 3/20 0.49
FABP3 P05413 1/20 0.49
FABP4 P15090 1/20 0.49

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
SCHEMBL31160335 1.00 KDM4E (0.61) KDM4EMPOKMT2AHDAC6MMP2
Furfural SCHEMBL28044818 0.83 ALDH1A1 (0.46) KDM4EMPOKMT2AHDAC6MMP2
SCHEMBL16156819 0.82 HDAC6 (0.73) KDM4EKMT2AHDAC6PLA2G2AHDAC1
SCHEMBL3318685 0.79 KDM4E (0.62) KDM4EMPOKMT2AGLAALDH1A1
SCHEMBL3322075 0.79 KDM4E (0.68) KDM4EHDAC6GLATSPOPOLB
SCHEMBL14003751 0.78 KDM4E (0.73) KDM4EHDAC6GLATSPOPOLB
SCHEMBL14003754 0.78 KDM4E (0.73) KDM4EHDAC6GLATSPOPOLB
SCHEMBL150053 0.76 KDM4E (1.00) KDM4EKMT2AGLATSPOALDH1A1
SCHEMBL29859932 0.76 KDM4E (1.00) KDM4EKMT2AGLATSPOALDH1A1
SCHEMBL31160384 0.76 KDM4E (0.59) KDM4EHDAC6KRASGLATSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105175312-A 1-substituted-2-(carbazole-9-yl-acetic acid)-hydrazide Schiff base and preparation method thereof UNIV SHAANXI SCIENCE & TECH 2015-12-23 CN claimed
CN-105732476-A Carbazole-isatin type compound and preparation method and application thereof 吉首大学 2016-07-06 CN disclosed
CN-105175312-A 1-substituted-2-(carbazole-9-yl-acetic acid)-hydrazide Schiff base and preparation method thereof UNIV SHAANXI SCIENCE & TECH 2015-12-23 CN disclosed
CN-105175312-A 1-substituted-2-(carbazole-9-yl-acetic acid)-hydrazide Schiff base and preparation method thereof UNIV SHAANXI SCIENCE & TECH 2015-12-23 CN disclosed