SCHEMBL18768357

SCHEMBL18768357

CN(CC1CCN(Cc2ccccc2)CC1)C(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 4/20 0.52
▸ SLC6A2 P23975 1/20 0.51
▸ SLC6A4 P31645 1/20 0.51
▸ BCHE P06276 2/20 0.49
▸ MAOA P21397 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ BACE1 P56817 1/20 0.49

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
SCHEMBL18768567 0.93 MDM2 (0.49) —
SCHEMBL18768551 0.92 ATM (0.48) ACHE
SCHEMBL18768425 0.90 MEN1 (0.51) ACHEBCHEMAOAMAOBBACE1
SCHEMBL18768615 0.90 ATM (0.49) ACHESLC6A2SLC6A4
SCHEMBL18768405 0.89 MEN1 (0.52) ACHE
SCHEMBL18768411 0.88 LMNA (0.48) —
SCHEMBL18768434 0.88 — —
SCHEMBL18768424 0.87 AKR1C3 (0.49) ACHESLC6A2SLC6A4BCHEMAOA
SCHEMBL18768427 0.81 — —
SCHEMBL18768355 0.81 MAOB (0.64) MAOB

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-2017066705-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE AGAINST STRESS GRANULES AQUINNAH PHARMACEUTICALS, INC. (US) 2017-04-20 — — WO disclosed
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