SCHEMBL16803460

SCHEMBL16803460

O=C1CC(O)(C(F)(F)F)c2c(C3CCN(c4ncc(C(F)(F)F)cc4Cl)C3)n[nH]c2N1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LCAT P04180 19/20 0.69

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
SCHEMBL16648838 0.95 LCAT (0.73) LCAT
SCHEMBL16648711 0.85 LCAT (0.73) LCAT
SCHEMBL16803456 0.84 LCAT (0.67) LCAT
SCHEMBL16772233 0.83 LCAT (0.57) LCAT
SCHEMBL16648728 0.83 LCAT (0.74) LCAT
SCHEMBL16648673 0.82 LCAT (0.72) LCAT
SCHEMBL16648634 0.80 LCAT (0.72) LCAT
SCHEMBL16648612 0.80 LCAT (0.72) LCAT
SCHEMBL16649046 0.79 LCAT (0.72) LCAT
SCHEMBL16803462 0.79 LCAT (0.67) LCAT

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-2015087995-A1 CYCLOALKYL OR HETEROCYCLYL PYRAZOLOPYRIDINE DERIVATIVE 第一三共株式会社 2015-06-18 — — WO disclosed
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