SCHEMBL18768177

SCHEMBL18768177

CCN(CC1CCN(Cc2cc3ccccc3o2)CC1)C(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.44
▸ AKR1C3 P42330 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ HTR2B P41595 1/20 0.43

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
SCHEMBL18768593 0.87 AKR1C3 (0.44) FLT3AKR1C3
SCHEMBL18768434 0.86 — —
SCHEMBL18768595 0.86 AKR1C3 (0.45) FLT3AKR1C3
SCHEMBL18768433 0.85 HRH4 (0.57) AKR1C3
SCHEMBL18767441 0.85 AKR1C3 (0.43) AKR1C3
SCHEMBL18768427 0.83 — —
SCHEMBL18768575 0.83 — —
SCHEMBL18768576 0.83 LMNA (0.47) —
SCHEMBL18768416 0.83 AKR1C3 (0.44) AKR1C3
SCHEMBL18768367 0.81 BCHE (0.50) —

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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