SCHEMBL28045393

SCHEMBL28045393

CCC/C=N/N(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.41
KMT2A Q03164 10/20 0.41
MAPT P10636 9/20 0.41
TDP1 Q9NUW8 3/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 4/20 0.41
ALOX12 P18054 2/20 0.41
GAA P10253 3/20 0.41
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 3/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
TNNI3 P19429 1/20 0.37
TNNT2 P45379 1/20 0.37
TNNC1 P63316 1/20 0.37

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
SCHEMBL28045549 0.87 GAA (0.41) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL28045397 0.86 GAA (0.40) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL22473611 0.84 MEN1 (0.44) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL8525600 0.81 TAAR1 (0.42) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL8525598 0.81 TAAR1 (0.42) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL8497030 0.77 GAA (0.47) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL13669995 0.76 MEN1 (0.41) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL12667811 0.73 MEN1 (0.47) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL6979719 0.73 MEN1 (0.47) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL9515353 0.73 MEN1 (0.47) MEN1KMT2AMAPTTDP1SMN1; SMN2

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-105272793-B Method for synthesizing aryl hydrazone 南京理工大学 2017-02-15 CN disclosed
CN-105272793-A Method for synthesizing aryl hydrazone UNIV NANJING SCIENCE & TECH 2016-01-27 CN disclosed