SCHEMBL20405057

SCHEMBL20405057

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c(C(/N=C(\N)c5ccccc5)=N/Cc5ccccc5)ccc5ccccc45)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 5/20 0.36
▸ GRIN1 Q05586 3/20 0.35
▸ SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL20407205 0.91 GRIN2B (0.34) GRIN2BGRIN1
SCHEMBL24914154 0.90 GRIN2B (0.33) GRIN2BGRIN1
SCHEMBL23655126 0.90 GRIN2B (0.36) GRIN2BGRIN1SIGMAR1
SCHEMBL20404891 0.86 GRIN2B (0.43) GRIN2BGRIN1
SCHEMBL20407141 0.83 PDK2 (0.33) —
SCHEMBL20407034 0.82 GRIN2B (0.43) GRIN2BGRIN1SIGMAR1
SCHEMBL23464231 0.80 GRIN2B (0.41) GRIN2BGRIN1
SCHEMBL20407087 0.80 GRIN2B (0.38) GRIN2BGRIN1SIGMAR1
SCHEMBL20407166 0.79 GRIN2B (0.35) GRIN2BGRIN1SIGMAR1
SCHEMBL20405021 0.79 GRIN2B (0.36) GRIN2BGRIN1

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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