SCHEMBL8397646

SCHEMBL8397646

N=C(N)N(N)C(=Nc1ccc2c3c(cccc13)C=C2)Nc1ccc2c3c(cccc13)C=C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 2/20 0.43
SIGMAR1 Q99720 3/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 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
SCHEMBL6155066 0.93 SCN2A (0.45) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL8401575 0.81 SIGMAR1 (0.37) SCN2ASIGMAR1
SCHEMBL6721210 0.80 SCN2A (0.42) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6155032 0.79 SCN2A (0.64) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6154972 0.76 EPHX1 (0.36) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL8843195 0.74 KDM4E (0.40) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6156082 0.74 SCN2A (0.44) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6154456 0.72 SIGMAR1 (0.38) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6157307 0.72 SIGMAR1 (0.38) SCN2ASIGMAR1GRIN2DGRIN3BGRIN1
SCHEMBL6155027 0.71 KDM4E (0.34) SCN2A

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-0918460-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-06-02 EP disclosed
WO-1998004131-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1998-02-05 WO disclosed