SCHEMBL21148154

SCHEMBL21148154

CCOC(=O)Cc1ccc2nc(NC(=O)CC(C)(C)C)n(C3=CCC=C(F)C=C3)c2c1F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 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
SCHEMBL17582768 0.87 ALDH1A1 (0.34) ALDH1A1
SCHEMBL17583023 0.82 POLB (0.39) ALDH1A1
SCHEMBL30659085 0.82 POLB (0.39) ALDH1A1
SCHEMBL30659144 0.79 MAPT (0.38) ALDH1A1
SCHEMBL17582767 0.79 MAPT (0.38) ALDH1A1
SCHEMBL17582800 0.77 CSNK1D (0.33) —
SCHEMBL17583021 0.76 CSNK1D (0.32) —
SCHEMBL20110771 0.76 POLB (0.38) ALDH1A1
SCHEMBL17582771 0.73 CSNK1D (0.33) —
SCHEMBL21148153 0.73 ALDH1A1 (0.31) ALDH1A1

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-3191457-B1 BENZOIMIDAZOL-1,2-YL AMIDES AS Kv7 CHANNEL ACTIVATORS KNOPP BIOSCIENCES LLC (US) 2019-07-10 — — EP disclosed
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