SCHEMBL9268391

SCHEMBL9268391

Cc1ccc2c(c1)c1c(n2-c2cccc(-c3cccc(-c4cccc(-n5c6ccncc6c6cc(C)ccc65)n4)n3)n2)C=CNC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32

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
SCHEMBL4562476 0.84 ACHE (0.40) ACHEGRIN1GRIN2A
SCHEMBL13070194 0.83 MAOA (0.32) ACHE
SCHEMBL4562149 0.83 ACHE (0.40) ACHEGRIN1GRIN2A
SCHEMBL13892742 0.81 MAOA (0.33) ACHE
SCHEMBL13892741 0.79 KARS1 (0.30)
SCHEMBL13070367 0.78 KDM4E (0.30)
SCHEMBL16625773 0.77 ACHE (0.42) ACHEGRIN1GRIN2A
SCHEMBL4562463 0.76 MAPT (0.36) ACHEGRIN1GRIN2A
SCHEMBL17874990 0.75 ACHE (0.37) ACHEGRIN1GRIN2A
SCHEMBL4562466 0.75 MAPT (0.36) ACHEGRIN1GRIN2A

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-2457912-A1 Compound having pyridoindole ring structure having substituted pyridyl group attached thereto, and organic electroluminescence element Hodogaya Chemical Co., Ltd. (JP) 2012-05-30 EP disclosed