SCHEMBL20962501

SCHEMBL20962501

N/C(=N\C(=N/Cc1cccc(-c2ccc3ccc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3c2)c1)c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 14/20 0.43
▸ GRIN1 Q05586 6/20 0.41
▸ GRIN2D O15399 2/20 0.38
▸ GRIN3B O60391 2/20 0.38
▸ GRIN2A Q12879 2/20 0.38
▸ GRIN2C Q14957 2/20 0.38
▸ GRIN3A Q8TCU5 2/20 0.38
▸ TPH1 P17752 1/20 0.35
▸ NOS2 P35228 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33

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
SCHEMBL23193236 0.82 GRIN2B (0.45) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL26712139 0.80 GRIN2B (0.56) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL18333505 0.80 GRIN2B (0.53) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL22893129 0.79 GRIN2B (0.49) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL26224333 0.78 GRIN2B (0.48) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL19313579 0.78 GRIN2B (0.39) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL25653149 0.77 GRIN2B (0.40) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL21845606 0.76 GRIN2B (0.37) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL23464231 0.76 GRIN2B (0.41) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL22813116 0.75 GRIN2B (0.50) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A

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-3477720-A1 ORGANIC LIGHT EMITTING ELEMENT LG Chem, Ltd. (KR) 2019-05-01 — — EP disclosed
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