SCHEMBL13044403

SCHEMBL13044403

COc1ccc(/C=N/OC(C)=O)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
GRIN2D O15399 2/20 0.58
GRIN3B O60391 2/20 0.58
GRIN1 Q05586 2/20 0.58
GRIN2A Q12879 2/20 0.58
GRIN2B Q13224 2/20 0.58
GRIN2C Q14957 2/20 0.58
GRIN3A Q8TCU5 2/20 0.58
ALDH1A1 P00352 4/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
CYP1A2 P05177 3/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1B1 Q16678 1/20 0.53
HPGD P15428 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
KDM4E B2RXH2 2/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL13128166 0.80 CYP1A2 (0.63) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL215465 0.80 GRIN2D (0.55) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL215464 0.80 GRIN2D (0.55) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8237102 0.77 GRIN2D (0.64) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2009040 0.77 GRIN2D (0.64) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2009041 0.77 GRIN2D (0.64) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4257971 0.77 ALDH1A1 (0.65) MAPTALDH1A1MEN1KMT2ACYP1A2
SCHEMBL30481109 0.77 GRIN2D (0.64) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11747282 0.77 GRIN2D (0.73) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13497655 0.76 MAOB (0.49) MAPTALDH1A1MEN1KMT2ACYP1A2

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
US-7829257-B2 Photosensitive resin composition CIBA SPECIALTY CHEMICALS CORP. (US) 2010-11-09 US disclosed
US-7829257-B2 Photosensitive resin composition CIBA SPECIALTY CHEMICALS CORP. (US) 2010-11-09 US disclosed