SCHEMBL24689749

SCHEMBL24689749

Cc1ccc(-c2cccc(-c3ccccc3-c3ccccc3-c3cccc(-c4ccc(C/N=C(\N)c5ccccc5)cc4)c3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 13/20 0.58
▸ GRIN1 Q05586 4/20 0.52
▸ NOS2 P35228 1/20 0.47
▸ DHODH Q02127 1/20 0.42
▸ SCN2A Q99250 1/20 0.41
▸ GRIN2D O15399 1/20 0.39
▸ GRIN3B O60391 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ GRIN2C Q14957 1/20 0.39
▸ GRIN3A Q8TCU5 1/20 0.39
▸ MALT1 Q9UDY8 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ HIF1A Q16665 1/20 0.38

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
SCHEMBL19688443 0.75 GRIN2B (1.00) GRIN2BGRIN1NOS2GRIN2DGRIN3B
SCHEMBL20860962 0.73 GRIN2B (0.69) GRIN2BGRIN1NOS2
SCHEMBL456941 0.72 GRIN2B (1.00) GRIN2BGRIN1NOS2GRIN2DGRIN3B
SCHEMBL17196594 0.72 GRIN2B (1.00) GRIN2BGRIN1NOS2GRIN2DGRIN3B
SCHEMBL22328727 0.71 GRIN2B (0.46) GRIN2BGRIN1NOS2SCN2ACYP2D6
SCHEMBL24715257 0.71 L3MBTL1 (0.48) DHODH
SCHEMBL24715118 0.71 GRIN2B (0.48) GRIN2BGRIN1MALT1
SCHEMBL30389865 0.70 SCN2A (0.49) GRIN2BGRIN1NOS2SCN2A
SCHEMBL30762058 0.70 SCN2A (0.49) GRIN2BGRIN1NOS2SCN2A
SCHEMBL26712139 0.69 GRIN2B (0.56) GRIN2BGRIN1NOS2DHODHGRIN2D

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
WO-2022191681-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-09-15 — — WO disclosed
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