SCHEMBL11068786

SCHEMBL11068786

O=c1[nH]c2cc3[nH]c(=O)c(=O)oc3cc2oc1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.42
NOS1 P29475 4/20 0.36
NOS3 P29474 3/20 0.36
NOS2 P35228 3/20 0.36
GRIN2D O15399 7/20 0.36
GRIN3B O60391 7/20 0.36
GRIN1 Q05586 7/20 0.36
GRIN2A Q12879 7/20 0.36
GRIN2B Q13224 7/20 0.36
GRIN2C Q14957 7/20 0.36
GRIN3A Q8TCU5 7/20 0.36
LMNA P02545 3/20 0.36
CYP1A2 P05177 3/20 0.36
BLM P54132 3/20 0.36
KDM4E B2RXH2 3/20 0.36
TSHR P16473 2/20 0.36
THPO P40225 2/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GRIA1 P42261 2/20 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
SCHEMBL10653075 0.78 GRIN2D (0.55) KMOGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8871995 0.76 PSMB8 (0.58) NOS1NOS3NOS2GRIN2DGRIN3B
SCHEMBL15333188 0.73 KIF11 (0.41) NOS1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL15329645 0.73 KIF11 (0.41) NOS1NOS3NOS2GRIN2DGRIN3B
SCHEMBL6429912 0.73 OGT (0.63) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11119376 0.71 GRIN2D (0.41) NOS1NOS3NOS2GRIN2DGRIN3B
SCHEMBL9679621 0.64 KMO (0.59) KMONOS1NOS3NOS2LMNA
SCHEMBL6407742 0.63 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3360077 0.63 DAO (0.46) LMNACYP1A2KDM4EMEN1KMT2A
SCHEMBL8873073 0.63 GRIN2D (0.52) KMONOS1NOS3NOS2GRIN2D

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
EP-0123151-A1 Benzobisoxazinetetrones RORER PHARMACEUTICAL CORPORATION (US) 1984-10-31 EP disclosed
US-4476125-A Benzobisoxazinetetrones and anti-allergic use thereof USV PHARMACEUTICAL CORPORATION (US) 1984-10-09 US disclosed