SCHEMBL3953773

SCHEMBL3953773

C=CCN(CC=C)CCOc1ccc(/N=N/c2ccc(OCCN(CC=C)CC=C)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.59
KMT2A Q03164 5/20 0.59
MEN1 O00255 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALDH1A1 P00352 6/20 0.55
L3MBTL1 Q9Y468 2/20 0.47
ATM Q13315 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 1/20 0.41
CHRNA7 P36544 1/20 0.38
CHRNA10 Q9GZZ6 1/20 0.38
CHRNA9 Q9UGM1 1/20 0.38
EBP Q15125 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
LSS P48449 4/20 0.36
CYP1A2 P05177 1/20 0.36
LTA4H P09960 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL3953775 1.00 KDM4E (0.59) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL9940218 0.79 KDM4E (0.61) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL219418 0.78 KDM4E (0.60) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL7055956 0.76 KDM4E (0.67) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL5176969 0.75 KDM4E (0.65) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL10056652 0.74 CA12 (0.53) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL29245578 0.74 CA12 (0.53) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL25867842 0.74 L3MBTL1 (0.51) KMT2AMEN1ALDH1A1L3MBTL1CHRNA7
SCHEMBL28330590 0.73 HRH3 (0.61) KDM4ESMN1; SMN2ALDH1A1LSSCYP1A2
SCHEMBL8553424 0.71 KDM4E (0.58) KDM4EKMT2AMEN1SMN1; SMN2ALDH1A1

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
JP-2009132641-A GOLDEN SOLID AZO COMPOUND AND ITS PRODUCTION METHOD YOSHINO NORIO 2009-06-18 JP disclosed