SCHEMBL20404891

SCHEMBL20404891

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccccc4C(/N=C(\N)c4ccccc4)=N/Cc4ccccc4)cc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 9/20 0.43
▸ GRIN1 Q05586 3/20 0.40
▸ PDK2 Q15119 7/20 0.35
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33
▸ GRIN2A Q12879 1/20 0.33
▸ GRIN2C Q14957 1/20 0.33
▸ GRIN3A Q8TCU5 1/20 0.33
▸ NOS2 P35228 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
SCHEMBL20405021 0.90 GRIN2B (0.36) GRIN2BGRIN1PDK2
SCHEMBL23655190 0.89 GRIN2B (0.39) GRIN2BGRIN1PDK2NOS2
SCHEMBL20405557 0.89 GRIN2B (0.41) GRIN2BGRIN1PDK2GRIN2DGRIN3B
SCHEMBL23464231 0.87 GRIN2B (0.41) GRIN2BGRIN1PDK2GRIN2DGRIN3B
SCHEMBL20405057 0.86 GRIN2B (0.36) GRIN2BGRIN1
SCHEMBL20407134 0.82 GRIN2B (0.34) GRIN2BGRIN1PDK2
SCHEMBL26937590 0.79 GRIN2B (0.42) GRIN2BGRIN1PDK2GRIN2DGRIN3B
SCHEMBL26166960 0.79 GRIN2B (0.46) GRIN2BGRIN1PDK2GRIN2DGRIN3B
SCHEMBL21159663 0.79 GRIN2B (0.34) GRIN2BGRIN1PDK2
SCHEMBL20407137 0.78 GRIN2B (0.47) 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-3351536-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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