SCHEMBL20145397

SCHEMBL20145397

CCCN(CCC)CCCN1CCc2[nH]c3ccc(C)cc3c2C1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.75
GRIN1 Q05586 3/20 0.75
GRIN2A Q12879 3/20 0.75
GRIN2D O15399 2/20 0.75
GRIN3B O60391 2/20 0.75
GRIN2B Q13224 2/20 0.75
GRIN2C Q14957 2/20 0.75
GRIN3A Q8TCU5 2/20 0.75
L3MBTL1 Q9Y468 1/20 0.57
LMNA P02545 1/20 0.52
PABPC1 P11940 1/20 0.52
ATM Q13315 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SIGMAR1 Q99720 4/20 0.51
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
BAZ2B Q9UIF8 1/20 0.50
NPC1 O15118 1/20 0.48

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
SCHEMBL3724766 0.89 ACHE (0.86) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2246410 0.88 ACHE (0.88) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL16387807 0.85 ACHE (0.69) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL7137991 0.83 ACHE (0.84) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2188478 0.83 ACHE (0.84) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2188030 0.81 ACHE (0.76) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2189750 0.80 ACHE (0.79) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL7134093 0.77 ACHE (0.73) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2192272 0.75 ACHE (0.70) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL168487 0.75 ACHE (0.70) ACHEGRIN1GRIN2AGRIN2DGRIN3B

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-3013824-B1 CARBOLINE COMPOUNDS USABLE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES ALZPROTECT (FR) 2018-05-16 EP disclosed