SCHEMBL20407137

SCHEMBL20407137

N/C(=N\C(=N/Cc1ccccc1)c1ccccc1-c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 8/20 0.47
▸ GRIN1 Q05586 4/20 0.45
▸ MEN1 O00255 7/20 0.41
▸ KMT2A Q03164 7/20 0.41
▸ MAPT P10636 6/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ HPGD P15428 5/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ ATP4A P20648 2/20 0.38
▸ ATP4B P51164 2/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ GRIN2D O15399 1/20 0.36
▸ GRIN3B O60391 1/20 0.36
▸ GRIN2A Q12879 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
SCHEMBL20405167 0.92 GRIN2B (0.40) GRIN2BGRIN1MEN1KMT2AMAPT
SCHEMBL22893129 0.82 GRIN2B (0.49) GRIN2BGRIN1MEN1KMT2AATP4A
SCHEMBL20407175 0.82 GRIN2B (0.38) GRIN2BGRIN1MEN1KMT2AMAPT
SCHEMBL26224333 0.81 GRIN2B (0.48) GRIN2BGRIN1MEN1KMT2AATP4A
SCHEMBL18965423 0.79 GRIN2B (0.52) GRIN2BGRIN1MEN1KMT2AMAPT
SCHEMBL20404891 0.78 GRIN2B (0.43) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL20405020 0.78 ALDH1A1 (0.44) GRIN2BGRIN1MEN1KMT2AMAPT
SCHEMBL20405557 0.77 GRIN2B (0.41) GRIN2BGRIN1ALDH1A1GRIN2DGRIN3B
SCHEMBL20405352 0.76 GRIN2B (0.47) GRIN2BGRIN1MEN1KMT2AMAPT
SCHEMBL24715118 0.76 GRIN2B (0.48) GRIN2BGRIN1MEN1KMT2AMAPT

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
EP-3351537-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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